(3S)-3-AMINO-2,3,4,5-TETRAHYDRO-2-OXO-1H-1-BENZAZEPINE-1-ACETATIC ACID 1,2-DIMETHYLETHYL ESTER, (2R,3R)-2,3-DIHYDROXYBUTANEDIOATE(1:1)

CAS No.
182561-27-9
CCD No.
CCD01967861
Formula
C16 H22 N2 O3 . C4 H6 O6
MolWeight
440.446

Basic Information

Product Name: (3S)-3-AMINO-2,3,4,5-TETRAHYDRO-2-OXO-1H-1-BENZAZEPINE-1-ACETATIC ACID 1,2-DIMETHYLETHYL ESTER, (2R,3R)-2,3-DIHYDROXYBUTANEDIOATE(1:1)
CAS: 182561-27-9
English Synonyms: (S)-3-AMINO-2,3,4,5-TETRAHYDRO-2-OXO-1H-1-BENZAZEPINE-1-ACETATIC ACID1,2-DIMETHYLETHYL ESTER,(2R,3R)-2,3-DIHYDROXYBUTANEDIOATE(1:1) ; (1:1) (3S)-3-AMINO-2,3,4,5-TETRAHYDRO-2-OXO-1H-1-BENZAZEPINE-1-ACETATIC ACID1,2-DIMETHYLETHYL ESTER,(2R,3R)-2,3-DIHYDROXYBUTANEDIOATE(1:1) ; (S)-3-AMINO-2,3,4,5-TETRAHYDRO-2-OXO-1H-1-BENZAZEPINE-1-ACETATIC ACID 1,2-DIMETHYLETHYL ESTER,(2R,3R)-2,3-DIHYDROXYBUTANEDIOATE(1:1) ; (3S)-3-AMINO-2,3,4,5-TETRAHYDRO-2-OXO-1H-1-BENZAZEPINE-1-ACETATIC ACID 1,2-DIMETHYLETHYL ESTER, (2R,3R)-2,3-DIHYDROXYBUTANEDIOATE(1:1)
MDL Number.: MFCD13152162
H bond acceptor: 5
H bond donor: 1
Smile: CCC(C)OC(=O)CN1c2ccccc2CC[C@@H](C1=O)N.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
InChi: InChI=1S/C16H22N2O3.C4H6O6/c1-3-11(2)21-15(19)10-18-14-7-5-4-6-12(14)8-9-13(17)16(18)20;5-1(3(7)8)2(6)4(9)10/h4-7,11,13H,3,8-10,17H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/t11?,13-;1-,2-/m01/s1
InChiKey: InChIKey=SMVCNOHOEVTUAS-VUBHDIFTSA-N

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