ethyl 4-(4-pyridin-4-ylpiperazin-1-yl)benzoate

Systemtic Name: ethyl 4-(4-pyridin-4-ylpiperazin-1-yl)benzoate Openeye Name: ethyl 4-[4-(4-pyridyl)piperazin-1-yl]benzoate CAS Name: 4-(4-pyridin-4-yl-1-piperazinyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-pyridin-4-ylpiperazin-1-yl)benzoate Traditional Name: 4-[4-(4-pyridyl)piperazino]benzoic acid ethyl ester Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C18H21N3O2/c1-2-23-18(22)15-3-5-16(6-4-15)20-11-13-21(14-12-20)17-7-9-19-10-8-17/h3-10H,2,11-14H2,1H3