(4-methylphenyl) 3-[3-[3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]-3-oxidanylidene-propyl]indole-1-sulfinate

Systemtic Name: (4-methylphenyl) 3-[3-[3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]-3-oxidanylidene-propyl]indole-1-sulfinate Openeye Name: p-tolyl 3-[3-[3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]-3-oxo-propyl]indole-1-sulfinate CAS Name: 3-[3-[3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]-1-indolesulfinic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 3-[3-[3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]indole-1-sulfinate Traditional Name: 3-[3-[3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]-3-keto-propyl]indole-1-sulfinic acid p-tolyl ester Formula: C30H33N3O3S MolecularWeight: 515.66632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)N2C=C(C3=CC=CC=C32)CCC(=O)N4CC(CC5=CC=CC=C54)CN(C)C

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)N2C=C(C3=CC=CC=C32)CCC(=O)N4CC(CC5=CC=CC=C54)CN(C)C

InChI

InChI=1S/C30H33N3O3S/c1-22-12-15-26(16-13-22)36-37(35)33-21-25(27-9-5-7-11-29(27)33)14-17-30(34)32-20-23(19-31(2)3)18-24-8-4-6-10-28(24)32/h4-13,15-16,21,23H,14,17-20H2,1-3H3