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

Systemtic Name: 2-ethoxyethyl (4S,7S)-2-methyl-4-(6-methyl-4-oxidanylidene-chromen-3-yl)-5-oxidanylidene-7-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: 2-ethoxyethyl (4S,7S)-2-methyl-4-(6-methyl-4-oxo-chromen-3-yl)-5-oxo-7-(2-thienyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S,7S)-2-methyl-4-(6-methyl-4-oxo-1-benzopyran-3-yl)-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl (4S,7S)-2-methyl-4-(6-methyl-4-oxochromen-3-yl)-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S,7S)-5-keto-4-(4-keto-6-methyl-chromen-3-yl)-2-methyl-7-(2-thienyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid 2-ethoxyethyl ester Formula: C29H29NO6S MolecularWeight: 519.60866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CS3)N=C1C)C4=COC5=C(C4=O)C=C(C=C5)C

Isomeric SMILES

CCOCCOC(=O)C1[C@@H](C2=C(C[C@@H](CC2=O)C3=CC=CS3)N=C1C)C4=COC5=C(C4=O)C=C(C=C5)C

InChI

InChI=1S/C29H29NO6S/c1-4-34-9-10-35-29(33)25-17(3)30-21-13-18(24-6-5-11-37-24)14-22(31)27(21)26(25)20-15-36-23-8-7-16(2)12-19(23)28(20)32/h5-8,11-12,15,18,25-26H,4,9-10,13-14H2,1-3H3/t18-,25?,26-/m0/s1