methyl 4-[4-(2-pyridin-2-ylethylcarbamoyl)piperidin-1-yl]carbonylbenzoate

Systemtic Name: methyl 4-[4-(2-pyridin-2-ylethylcarbamoyl)piperidin-1-yl]carbonylbenzoate Openeye Name: methyl 4-[4-[2-(2-pyridyl)ethylcarbamoyl]piperidine-1-carbonyl]benzoate CAS Name: 4-[oxo-[4-[oxo-[2-(2-pyridinyl)ethylamino]methyl]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(2-pyridin-2-ylethylcarbamoyl)piperidine-1-carbonyl]benzoate Traditional Name: 4-[4-[2-(2-pyridyl)ethylcarbamoyl]piperidine-1-carbonyl]benzoic acid methyl ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)NCCC3=CC=CC=N3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)NCCC3=CC=CC=N3

InChI

InChI=1S/C22H25N3O4/c1-29-22(28)18-7-5-17(6-8-18)21(27)25-14-10-16(11-15-25)20(26)24-13-9-19-4-2-3-12-23-19/h2-8,12,16H,9-11,13-15H2,1H3,(H,24,26)