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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1Cl)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1Cl)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

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