methyl 7-chloranyl-3-[[4-(2-hydroxyethylcarbamoyl)phenyl]methyl]-4-oxidanylidene-1-phenyl-quinoline-2-carboxylate

Systemtic Name: methyl 7-chloranyl-3-[[4-(2-hydroxyethylcarbamoyl)phenyl]methyl]-4-oxidanylidene-1-phenyl-quinoline-2-carboxylate Openeye Name: methyl 7-chloro-3-[[4-(2-hydroxyethylcarbamoyl)phenyl]methyl]-4-oxo-1-phenyl-quinoline-2-carboxylate CAS Name: 7-chloro-3-[[4-[(2-hydroxyethylamino)-oxomethyl]phenyl]methyl]-4-oxo-1-phenyl-2-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 7-chloro-3-[[4-(2-hydroxyethylcarbamoyl)phenyl]methyl]-4-oxo-1-phenylquinoline-2-carboxylate Traditional Name: 7-chloro-3-[4-(2-hydroxyethylcarbamoyl)benzyl]-4-keto-1-phenyl-quinaldic acid methyl ester Formula: C27H23ClN2O5 MolecularWeight: 490.93492

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=O)C2=C(N1C3=CC=CC=C3)C=C(C=C2)Cl)CC4=CC=C(C=C4)C(=O)NCCO

Isomeric SMILES

COC(=O)C1=C(C(=O)C2=C(N1C3=CC=CC=C3)C=C(C=C2)Cl)CC4=CC=C(C=C4)C(=O)NCCO

InChI

InChI=1S/C27H23ClN2O5/c1-35-27(34)24-22(15-17-7-9-18(10-8-17)26(33)29-13-14-31)25(32)21-12-11-19(28)16-23(21)30(24)20-5-3-2-4-6-20/h2-12,16,31H,13-15H2,1H3,(H,29,33)