N-ethyl-5-nitro-N-phenyl-2-[4-(phenylmethyl)piperazin-1-yl]benzamide

Systemtic Name: N-ethyl-5-nitro-N-phenyl-2-[4-(phenylmethyl)piperazin-1-yl]benzamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-ethyl-5-nitro-N-phenyl-benzamide CAS Name: N-ethyl-5-nitro-N-phenyl-2-[4-(phenylmethyl)-1-piperazinyl]benzamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-ethyl-5-nitro-N-phenylbenzamide Traditional Name: 2-(4-benzylpiperazino)-N-ethyl-5-nitro-N-phenyl-benzamide Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H28N4O3/c1-2-29(22-11-7-4-8-12-22)26(31)24-19-23(30(32)33)13-14-25(24)28-17-15-27(16-18-28)20-21-9-5-3-6-10-21/h3-14,19H,2,15-18,20H2,1H3