4-chloranylbenzenesulfinate; (4-methylphenyl)-[[(4-methylphenyl)amino]-phenyl-methylidene]azanium

Systemtic Name: 4-chloranylbenzenesulfinate; (4-methylphenyl)-[[(4-methylphenyl)amino]-phenyl-methylidene]azanium Openeye Name: 4-chlorobenzenesulfinate; [(4-methylanilino)-phenyl-methylene]-(p-tolyl)ammonium CAS Name: 4-chlorobenzenesulfinate; [(4-methylanilino)-phenylmethylidene]-(4-methylphenyl)ammonium IUPAC Name: 4-chlorobenzenesulfinate; [(4-methylanilino)-phenylmethylidene]-(4-methylphenyl)azanium Traditional Name: 4-chlorobenzenesulfinate; [phenyl(p-toluidino)methylene]-(p-tolyl)ammonium Formula: C27H25ClN2O2S MolecularWeight: 477.0176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=[NH+]C2=CC=C(C=C2)C)C3=CC=CC=C3.C1=CC(=CC=C1S(=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=[NH+]C2=CC=C(C=C2)C)C3=CC=CC=C3.C1=CC(=CC=C1S(=O)[O-])Cl

InChI

InChI=1S/C21H20N2.C6H5ClO2S/c1-16-8-12-19(13-9-16)22-21(18-6-4-3-5-7-18)23-20-14-10-17(2)11-15-20;7-5-1-3-6(4-2-5)10(8)9/h3-15H,1-2H3,(H,22,23);1-4H,(H,8,9)