N'-(4-acetamidophenyl)-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]ethanediamide

Systemtic Name: N'-(4-acetamidophenyl)-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]ethanediamide Openeye Name: N'-(4-acetamidophenyl)-N-[[1-(3-pyridylmethyl)-4-piperidyl]methyl]oxamide CAS Name: N'-(4-acetamidophenyl)-N-[[1-(3-pyridinylmethyl)-4-piperidinyl]methyl]oxamide IUPAC Name: N'-(4-acetamidophenyl)-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]oxamide Traditional Name: N'-(4-acetamidophenyl)-N-[[1-(3-pyridylmethyl)-4-piperidyl]methyl]oxamide Formula: C22H27N5O3 MolecularWeight: 409.48148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C(=O)NCC2CCN(CC2)CC3=CN=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C(=O)NCC2CCN(CC2)CC3=CN=CC=C3

InChI

InChI=1S/C22H27N5O3/c1-16(28)25-19-4-6-20(7-5-19)26-22(30)21(29)24-14-17-8-11-27(12-9-17)15-18-3-2-10-23-13-18/h2-7,10,13,17H,8-9,11-12,14-15H2,1H3,(H,24,29)(H,25,28)(H,26,30)