1-[2-[(3-methylphenyl)carbonylamino]ethanoyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[(3-methylphenyl)carbonylamino]ethanoyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[2-[(3-methylbenzoyl)amino]acetyl]-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[2-[[(3-methylphenyl)-oxomethyl]amino]-1-oxoethyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-[(3-methylbenzoyl)amino]acetyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-[2-(m-toluoylamino)acetyl]-N-(3-pyridylmethyl)isonipecotamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC(=O)N2CCC(CC2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC(=O)N2CCC(CC2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C22H26N4O3/c1-16-4-2-6-19(12-16)22(29)25-15-20(27)26-10-7-18(8-11-26)21(28)24-14-17-5-3-9-23-13-17/h2-6,9,12-13,18H,7-8,10-11,14-15H2,1H3,(H,24,28)(H,25,29)