N-(2-chloranyl-4-nitro-phenyl)-2-[4-(phenylmethyl)piperidin-1-yl]ethanamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-[4-(phenylmethyl)piperidin-1-yl]ethanamide Openeye Name: 2-(4-benzyl-1-piperidyl)-N-(2-chloro-4-nitro-phenyl)acetamide CAS Name: N-(2-chloro-4-nitrophenyl)-2-[4-(phenylmethyl)-1-piperidinyl]acetamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-N-(2-chloro-4-nitrophenyl)acetamide Traditional Name: 2-(4-benzylpiperidino)-N-(2-chloro-4-nitro-phenyl)acetamide Formula: C20H22ClN3O3 MolecularWeight: 387.85998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H22ClN3O3/c21-18-13-17(24(26)27)6-7-19(18)22-20(25)14-23-10-8-16(9-11-23)12-15-4-2-1-3-5-15/h1-7,13,16H,8-12,14H2,(H,22,25)