phenethyl 2-methyl-4-(6-methyl-4-oxidanylidene-chromen-3-yl)-5-oxidanylidene-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: phenethyl 2-methyl-4-(6-methyl-4-oxidanylidene-chromen-3-yl)-5-oxidanylidene-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: phenethyl 2-methyl-4-(6-methyl-4-oxo-chromen-3-yl)-5-oxo-7-(2-thienyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 2-methyl-4-(6-methyl-4-oxo-1-benzopyran-3-yl)-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid phenethyl ester IUPAC Name: phenethyl 2-methyl-4-(6-methyl-4-oxochromen-3-yl)-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 5-keto-4-(4-keto-6-methyl-chromen-3-yl)-2-methyl-7-(2-thienyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid phenethyl ester Formula: C33H29NO5S MolecularWeight: 551.65206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC=C(C2=O)C3C4=C(CC(CC4=O)C5=CC=CS5)NC(=C3C(=O)OCCC6=CC=CC=C6)C

Isomeric SMILES

CC1=CC2=C(C=C1)OC=C(C2=O)C3C4=C(CC(CC4=O)C5=CC=CS5)NC(=C3C(=O)OCCC6=CC=CC=C6)C

InChI

InChI=1S/C33H29NO5S/c1-19-10-11-27-23(15-19)32(36)24(18-39-27)30-29(33(37)38-13-12-21-7-4-3-5-8-21)20(2)34-25-16-22(17-26(35)31(25)30)28-9-6-14-40-28/h3-11,14-15,18,22,30,34H,12-13,16-17H2,1-2H3