ethyl 4-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-1-methyl-2-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-1-methyl-2-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 4-[4-(4-chlorobenzoyl)piperazin-1-yl]-1-methyl-2-oxo-quinoline-3-carboxylate CAS Name: 4-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-1-methyl-2-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-chlorobenzoyl)piperazin-1-yl]-1-methyl-2-oxoquinoline-3-carboxylate Traditional Name: 4-[4-(4-chlorobenzoyl)piperazino]-2-keto-1-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C24H24ClN3O4 MolecularWeight: 453.91806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N(C1=O)C)N3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N(C1=O)C)N3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H24ClN3O4/c1-3-32-24(31)20-21(18-6-4-5-7-19(18)26(2)23(20)30)27-12-14-28(15-13-27)22(29)16-8-10-17(25)11-9-16/h4-11H,3,12-15H2,1-2H3