2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(4-nitrophenyl)propanamide

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(4-nitrophenyl)propanamide Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(4-nitrophenyl)propanamide CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-N-(4-nitrophenyl)propanamide IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(4-nitrophenyl)propanamide Traditional Name: 2-[4-(3-chlorobenzyl)piperazino]-N-(4-nitrophenyl)propionamide Formula: C20H23ClN4O3 MolecularWeight: 402.87462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])N2CCN(CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])N2CCN(CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23ClN4O3/c1-15(20(26)22-18-5-7-19(8-6-18)25(27)28)24-11-9-23(10-12-24)14-16-3-2-4-17(21)13-16/h2-8,13,15H,9-12,14H2,1H3,(H,22,26)