ethyl 6-[4-[3-(4-methoxyphenyl)propanoyl]piperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[4-[3-(4-methoxyphenyl)propanoyl]piperazin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[4-[3-(4-methoxyphenyl)propanoyl]piperazin-1-yl]pyridine-3-carboxylate CAS Name: 6-[4-[3-(4-methoxyphenyl)-1-oxopropyl]-1-piperazinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-[3-(4-methoxyphenyl)propanoyl]piperazin-1-yl]pyridine-3-carboxylate Traditional Name: 6-[4-[3-(4-methoxyphenyl)propanoyl]piperazino]nicotinic acid ethyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27N3O4/c1-3-29-22(27)18-7-10-20(23-16-18)24-12-14-25(15-13-24)21(26)11-6-17-4-8-19(28-2)9-5-17/h4-5,7-10,16H,3,6,11-15H2,1-2H3