[1-(2-methanoyl-3-sulfo-phenyl)dodecan-4-yl-[(4-methylphenyl)-phenyl-amino]azaniumylidene]azanide

Systemtic Name: [1-(2-methanoyl-3-sulfo-phenyl)dodecan-4-yl-[(4-methylphenyl)-phenyl-amino]azaniumylidene]azanide Openeye Name: [1-[3-(2-formyl-3-sulfo-phenyl)propyl]nonyl-[N-(p-tolyl)anilino]iminio]azanide CAS Name: [1-(2-formyl-3-sulfophenyl)dodecan-4-yl-(N-(4-methylphenyl)anilino)iminio]azanide IUPAC Name: [1-(2-formyl-3-sulfophenyl)dodecan-4-yl-(N-(4-methylphenyl)anilino)azaniumylidene]azanide Traditional Name: [1-[3-(2-formyl-3-sulfo-phenyl)propyl]nonyl-[N-(p-tolyl)anilino]iminio]azanide Formula: C32H41N3O4S MolecularWeight: 563.75064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCC1=C(C(=CC=C1)S(=O)(=O)O)C=O)[N+](=[N-])N(C2=CC=CC=C2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCCC(CCCC1=C(C(=CC=C1)S(=O)(=O)O)C=O)[N+](=[N-])N(C2=CC=CC=C2)C3=CC=C(C=C3)C

InChI

InChI=1S/C32H41N3O4S/c1-3-4-5-6-7-9-18-30(19-12-14-27-15-13-20-32(31(27)25-36)40(37,38)39)35(33)34(28-16-10-8-11-17-28)29-23-21-26(2)22-24-29/h8,10-11,13,15-17,20-25,30H,3-7,9,12,14,18-19H2,1-2H3,(H,37,38,39)