methyl 4-[[4-[ethanoyl(pyridin-3-ylmethyl)amino]piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-[ethanoyl(pyridin-3-ylmethyl)amino]piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-[acetyl(3-pyridylmethyl)amino]-1-piperidyl]methyl]benzoate CAS Name: 4-[[4-[acetyl(3-pyridinylmethyl)amino]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[acetyl(pyridin-3-ylmethyl)amino]piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[4-[acetyl(3-pyridylmethyl)amino]piperidino]methyl]benzoic acid methyl ester Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1=CN=CC=C1)C2CCN(CC2)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(=O)N(CC1=CN=CC=C1)C2CCN(CC2)CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H27N3O3/c1-17(26)25(16-19-4-3-11-23-14-19)21-9-12-24(13-10-21)15-18-5-7-20(8-6-18)22(27)28-2/h3-8,11,14,21H,9-10,12-13,15-16H2,1-2H3