2-(3-nitrophenoxy)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide

Systemtic Name: 2-(3-nitrophenoxy)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(3-nitrophenoxy)acetamide CAS Name: 2-(3-nitrophenoxy)-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]acetamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(3-nitrophenoxy)acetamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2-(3-nitrophenoxy)acetamide Formula: C25H26N4O4 MolecularWeight: 446.49834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)COC4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)COC4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H26N4O4/c30-25(19-33-24-8-4-7-23(17-24)29(31)32)26-21-9-11-22(12-10-21)28-15-13-27(14-16-28)18-20-5-2-1-3-6-20/h1-12,17H,13-16,18-19H2,(H,26,30)