5-[3-(4-nitrophenyl)prop-2-enoylamino]-N-(1-phenylethyl)-2-piperidin-1-yl-benzamide

Systemtic Name: 5-[3-(4-nitrophenyl)prop-2-enoylamino]-N-(1-phenylethyl)-2-piperidin-1-yl-benzamide Openeye Name: 5-[3-(4-nitrophenyl)prop-2-enoylamino]-N-(1-phenylethyl)-2-(1-piperidyl)benzamide CAS Name: 5-[[3-(4-nitrophenyl)-1-oxoprop-2-enyl]amino]-N-(1-phenylethyl)-2-(1-piperidinyl)benzamide IUPAC Name: 5-[3-(4-nitrophenyl)prop-2-enoylamino]-N-(1-phenylethyl)-2-piperidin-1-ylbenzamide Traditional Name: 5-[[3-(4-nitrophenyl)acryloyl]amino]-N-(1-phenylethyl)-2-piperidino-benzamide Formula: C29H30N4O4 MolecularWeight: 498.5729

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-])N4CCCCC4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-])N4CCCCC4

InChI

InChI=1S/C29H30N4O4/c1-21(23-8-4-2-5-9-23)30-29(35)26-20-24(13-16-27(26)32-18-6-3-7-19-32)31-28(34)17-12-22-10-14-25(15-11-22)33(36)37/h2,4-5,8-17,20-21H,3,6-7,18-19H2,1H3,(H,30,35)(H,31,34)