BENZYL 4-CHLORO-5,6,8,9-TETRAHYDROPYRIMIDO[4,5-D]AZEPINE-7-CARBOXYLATE

CAS No.
1251001-37-2
CCD No.
CCD01018526
Formula
C16 H16 Cl N3 O2
MolWeight
317.774

Basic Information

Product Name: BENZYL 4-CHLORO-5,6,8,9-TETRAHYDROPYRIMIDO[4,5-D]AZEPINE-7-CARBOXYLATE
CAS: 1251001-37-2
English Synonyms: 7H-PYRIMIDO[4,5-D]AZEPINE-7-CARBOXYLIC ACID, 4-CHLORO-5,6,8,9-TETRAHYDRO-, PHENYLMETHYL ESTER ; 4-CHLORO-5,6,8,9-TETRAHYDRO-PYRIMIDO[4,5-D]AZEPINE-7-CARBOXYLIC ACID BENZYL ESTER ; BENZYL 4-CHLORO-5,6,8,9-TETRAHYDROPYRIMIDO[4,5-D]AZEPINE-7-CARBOXYLATE ; BENZYL 4-CHLORO-5H,6H,7H,8H,9H-PYRIMIDO[4,5-D]AZEPINE-7-CARBOXYLATE
MDL Number.: MFCD11111521
H bond acceptor: 5
H bond donor: 0
Smile: c1ccc(cc1)COC(=O)N2CCc3c(ncnc3Cl)CC2
InChi: InChI=1S/C16H16ClN3O2/c17-15-13-6-8-20(9-7-14(13)18-11-19-15)16(21)22-10-12-4-2-1-3-5-12/h1-5,11H,6-10H2
InChiKey: InChIKey=SCOCDDMKQDHYSW-UHFFFAOYSA-N

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