methyl-[6-[methyl(phenyl)amino]-9-(2-sulfophenyl)-5,6-dihydroxanthen-3-ylidene]-phenyl-azanium

Systemtic Name: methyl-[6-[methyl(phenyl)amino]-9-(2-sulfophenyl)-5,6-dihydroxanthen-3-ylidene]-phenyl-azanium Openeye Name: methyl-[6-(N-methylanilino)-9-(2-sulfophenyl)-5,6-dihydroxanthen-3-ylidene]-phenyl-ammonium CAS Name: methyl-[6-(N-methylanilino)-9-(2-sulfophenyl)-5,6-dihydroxanthen-3-ylidene]-phenylammonium IUPAC Name: methyl-[6-(N-methylanilino)-9-(2-sulfophenyl)-5,6-dihydroxanthen-3-ylidene]-phenylazanium Traditional Name: methyl-[6-(N-methylanilino)-9-(2-sulfophenyl)-5,6-dihydroxanthen-3-ylidene]-phenyl-ammonium Formula: C33H29N2O4S+ MolecularWeight: 549.65936

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CC2=C(C=C1)C(=C3C=CC(=[N+](C)C4=CC=CC=C4)C=C3O2)C5=CC=CC=C5S(=O)(=O)O)C6=CC=CC=C6

Isomeric SMILES

CN(C1CC2=C(C=C1)C(=C3C=CC(=[N+](C)C4=CC=CC=C4)C=C3O2)C5=CC=CC=C5S(=O)(=O)O)C6=CC=CC=C6

InChI

InChI=1S/C33H28N2O4S/c1-34(23-11-5-3-6-12-23)25-17-19-27-30(21-25)39-31-22-26(35(2)24-13-7-4-8-14-24)18-20-28(31)33(27)29-15-9-10-16-32(29)40(36,37)38/h3-21,26H,22H2,1-2H3/p+1