N-(3-ethoxypropyl)-5-[(3-nitrophenyl)carbonylamino]-2-[4-(phenylmethyl)piperidin-1-yl]benzamide

Systemtic Name: N-(3-ethoxypropyl)-5-[(3-nitrophenyl)carbonylamino]-2-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-N-(3-ethoxypropyl)-5-[(3-nitrobenzoyl)amino]benzamide CAS Name: N-(3-ethoxypropyl)-5-[[(3-nitrophenyl)-oxomethyl]amino]-2-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-N-(3-ethoxypropyl)-5-[(3-nitrobenzoyl)amino]benzamide Traditional Name: 2-(4-benzylpiperidino)-N-(3-ethoxypropyl)-5-[(3-nitrobenzoyl)amino]benzamide Formula: C31H36N4O5 MolecularWeight: 544.64134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C31H36N4O5/c1-2-40-19-7-16-32-31(37)28-22-26(33-30(36)25-10-6-11-27(21-25)35(38)39)12-13-29(28)34-17-14-24(15-18-34)20-23-8-4-3-5-9-23/h3-6,8-13,21-22,24H,2,7,14-20H2,1H3,(H,32,37)(H,33,36)