methyl 2-(2-chlorophenyl)-2-(4-quinolin-5-ylcarbonylpiperazin-1-yl)ethanoate

Systemtic Name: methyl 2-(2-chlorophenyl)-2-(4-quinolin-5-ylcarbonylpiperazin-1-yl)ethanoate Openeye Name: methyl 2-(2-chlorophenyl)-2-[4-(quinoline-5-carbonyl)piperazin-1-yl]acetate CAS Name: 2-(2-chlorophenyl)-2-[4-[oxo(5-quinolinyl)methyl]-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-(2-chlorophenyl)-2-[4-(quinoline-5-carbonyl)piperazin-1-yl]acetate Traditional Name: 2-(2-chlorophenyl)-2-[4-(quinoline-5-carbonyl)piperazino]acetic acid methyl ester Formula: C23H22ClN3O3 MolecularWeight: 423.89208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C(=O)C3=C4C=CC=NC4=CC=C3

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C(=O)C3=C4C=CC=NC4=CC=C3

InChI

InChI=1S/C23H22ClN3O3/c1-30-23(29)21(18-6-2-3-9-19(18)24)26-12-14-27(15-13-26)22(28)17-7-4-10-20-16(17)8-5-11-25-20/h2-11,21H,12-15H2,1H3