methyl 2-[[4-(7-chloranylquinolin-4-yl)piperazin-1-yl]carbonylamino]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[[4-(7-chloranylquinolin-4-yl)piperazin-1-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: methyl 2-[[4-(7-chloro-4-quinolyl)piperazine-1-carbonyl]amino]-2-phenyl-acetate CAS Name: 2-[[[4-(7-chloro-4-quinolinyl)-1-piperazinyl]-oxomethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[[4-(7-chloroquinolin-4-yl)piperazine-1-carbonyl]amino]-2-phenylacetate Traditional Name: 2-[[4-(7-chloro-4-quinolyl)piperazine-1-carbonyl]amino]-2-phenyl-acetic acid methyl ester Formula: C23H23ClN4O3 MolecularWeight: 438.90672

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)NC(=O)N2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)NC(=O)N2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C23H23ClN4O3/c1-31-22(29)21(16-5-3-2-4-6-16)26-23(30)28-13-11-27(12-14-28)20-9-10-25-19-15-17(24)7-8-18(19)20/h2-10,15,21H,11-14H2,1H3,(H,26,30)