methyl 2-[4-(3-chlorophenyl)piperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: methyl 2-[4-(3-chlorophenyl)piperazin-1-yl]pyridine-3-carboxylate Openeye Name: methyl 2-[4-(3-chlorophenyl)piperazin-1-yl]pyridine-3-carboxylate CAS Name: 2-[4-(3-chlorophenyl)-1-piperazinyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(3-chlorophenyl)piperazin-1-yl]pyridine-3-carboxylate Traditional Name: 2-[4-(3-chlorophenyl)piperazino]nicotinic acid methyl ester Formula: C17H18ClN3O2 MolecularWeight: 331.79672

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N=CC=C1)N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

COC(=O)C1=C(N=CC=C1)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H18ClN3O2/c1-23-17(22)15-6-3-7-19-16(15)21-10-8-20(9-11-21)14-5-2-4-13(18)12-14/h2-7,12H,8-11H2,1H3