methyl 3-[[4-(quinolin-3-ylmethyl)piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[4-(quinolin-3-ylmethyl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[4-(3-quinolylmethyl)piperazine-1-carbonyl]amino]benzoate CAS Name: 3-[[oxo-[4-(3-quinolinylmethyl)-1-piperazinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-(quinolin-3-ylmethyl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 3-[[4-(3-quinolylmethyl)piperazine-1-carbonyl]amino]benzoic acid methyl ester Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)N2CCN(CC2)CC3=CC4=CC=CC=C4N=C3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)N2CCN(CC2)CC3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C23H24N4O3/c1-30-22(28)19-6-4-7-20(14-19)25-23(29)27-11-9-26(10-12-27)16-17-13-18-5-2-3-8-21(18)24-15-17/h2-8,13-15H,9-12,16H2,1H3,(H,25,29)