ethyl 6-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]pyridine-3-carboxylate CAS Name: 6-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]pyridine-3-carboxylate Traditional Name: 6-[4-(5-chloro-2-methyl-phenyl)piperazino]nicotinic acid ethyl ester Formula: C19H22ClN3O2 MolecularWeight: 359.84988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C

InChI

InChI=1S/C19H22ClN3O2/c1-3-25-19(24)15-5-7-18(21-13-15)23-10-8-22(9-11-23)17-12-16(20)6-4-14(17)2/h4-7,12-13H,3,8-11H2,1-2H3