5,5'-DICYANO-3-(4-SULFOBUTYL)-1,1',3'-TRIETHYLIMIDACARBOCYANINE BETAINE

CAS No.
32634-36-9
CCD No.
CCD00091528
Formula
C29 H32 N6 O3 S
MolWeight
544.677

Basic Information

Product Name: 5,5'-DICYANO-3-(4-SULFOBUTYL)-1,1',3'-TRIETHYLIMIDACARBOCYANINE BETAINE
CAS: 32634-36-9
English Synonyms: 5,5'-DICYANO-3-(4-SULFOBUTYL)-1,1',3'-TRIETHYLIMIDACARBOCYANINE BETAINE
MDL Number.: MFCD00191956
H bond acceptor: 9
H bond donor: 0
Smile: CCn1c2ccc(cc2[n+](c1/C=C/C=C/3\N(c4ccc(cc4N3CC)C#N)CC)CCCCS(=O)(=O)[O-])C#N
InChi: InChI=1S/C29H32N6O3S/c1-4-32-24-14-12-22(20-30)18-26(24)34(6-3)28(32)10-9-11-29-33(5-2)25-15-13-23(21-31)19-27(25)35(29)16-7-8-17-39(36,37)38/h9-15,18-19H,4-8,16-17H2,1-3H3
InChiKey: InChIKey=YWYCGJBGMVFFMH-UHFFFAOYSA-N

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