[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 7-methoxythieno[2,3-b]quinoline-2-carboxylate

Systemtic Name: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 7-methoxythieno[2,3-b]quinoline-2-carboxylate Openeye Name: [2-(3,4-dimethylanilino)-2-oxo-ethyl] 7-methoxythieno[2,3-b]quinoline-2-carboxylate CAS Name: 7-methoxy-2-thieno[2,3-b]quinolinecarboxylic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylanilino)-2-oxoethyl] 7-methoxythieno[2,3-b]quinoline-2-carboxylate Traditional Name: 7-methoxythieno[2,3-b]quinoline-2-carboxylic acid [2-(3,4-dimethylanilino)-2-keto-ethyl] ester Formula: C23H20N2O4S MolecularWeight: 420.4809

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC3=C(S2)N=C4C=C(C=CC4=C3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC3=C(S2)N=C4C=C(C=CC4=C3)OC)C

InChI

InChI=1S/C23H20N2O4S/c1-13-4-6-17(8-14(13)2)24-21(26)12-29-23(27)20-10-16-9-15-5-7-18(28-3)11-19(15)25-22(16)30-20/h4-11H,12H2,1-3H3,(H,24,26)