methyl 3-[(1-heptyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(1-heptyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(1-heptyl-2-hydroxy-4-oxo-quinoline-3-carbonyl)amino]thiophene-2-carboxylate CAS Name: 3-[[(1-heptyl-2-hydroxy-4-oxo-3-quinolinyl)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(1-heptyl-2-hydroxy-4-oxoquinoline-3-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(1-heptyl-2-hydroxy-4-keto-quinoline-3-carbonyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C23H26N2O5S MolecularWeight: 442.52794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=C(SC=C3)C(=O)OC

Isomeric SMILES

CCCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C23H26N2O5S/c1-3-4-5-6-9-13-25-17-11-8-7-10-15(17)19(26)18(22(25)28)21(27)24-16-12-14-31-20(16)23(29)30-2/h7-8,10-12,14,28H,3-6,9,13H2,1-2H3,(H,24,27)