[3-[2-(dimethylamino)-2-oxidanylidene-ethyl]-3-methyl-4,9-dihydro-1H-furo[3,4-b]quinolin-9-yl] 4-methylbenzenesulfonate

Systemtic Name: [3-[2-(dimethylamino)-2-oxidanylidene-ethyl]-3-methyl-4,9-dihydro-1H-furo[3,4-b]quinolin-9-yl] 4-methylbenzenesulfonate Openeye Name: [3-[2-(dimethylamino)-2-oxo-ethyl]-3-methyl-4,9-dihydro-1H-furo[3,4-b]quinolin-9-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-[2-(dimethylamino)-2-oxoethyl]-3-methyl-4,9-dihydro-1H-furo[3,4-b]quinolin-9-yl] ester IUPAC Name: [3-[2-(dimethylamino)-2-oxoethyl]-3-methyl-4,9-dihydro-1H-furo[3,4-b]quinolin-9-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-[2-(dimethylamino)-2-keto-ethyl]-3-methyl-4,9-dihydro-1H-furo[3,4-b]quinolin-9-yl] ester Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2C3=C(C(OC3)(C)CC(=O)N(C)C)NC4=CC=CC=C24

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2C3=C(C(OC3)(C)CC(=O)N(C)C)NC4=CC=CC=C24

InChI

InChI=1S/C23H26N2O5S/c1-15-9-11-16(12-10-15)31(27,28)30-21-17-7-5-6-8-19(17)24-22-18(21)14-29-23(22,2)13-20(26)25(3)4/h5-12,21,24H,13-14H2,1-4H3