[1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate

Systemtic Name: [1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Openeye Name: [2-(2-methoxyanilino)-1-methyl-2-oxo-ethyl] 4,5-dihydrobenzo[g]benzothiophene-2-carboxylate CAS Name: 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylic acid [1-(2-methoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methoxyanilino)-1-oxopropan-2-yl] 4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Traditional Name: 4,5-dihydrobenzo[g]benzothiophene-2-carboxylic acid [2-keto-1-methyl-2-(o-anisidino)ethyl] ester Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1OC)OC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1OC)OC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

InChI

InChI=1S/C23H21NO4S/c1-14(22(25)24-18-9-5-6-10-19(18)27-2)28-23(26)20-13-16-12-11-15-7-3-4-8-17(15)21(16)29-20/h3-10,13-14H,11-12H2,1-2H3,(H,24,25)