2-nitro-N-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]benzamide

Systemtic Name: 2-nitro-N-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]benzamide Openeye Name: N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-2-nitro-benzamide CAS Name: 2-nitro-N-[4-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]benzamide IUPAC Name: N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-2-nitrobenzamide Traditional Name: N-[4-[(4-benzylpiperazino)methyl]phenyl]-2-nitro-benzamide Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C25H26N4O3/c30-25(23-8-4-5-9-24(23)29(31)32)26-22-12-10-21(11-13-22)19-28-16-14-27(15-17-28)18-20-6-2-1-3-7-20/h1-13H,14-19H2,(H,26,30)