N-(3-nitrophenyl)-2-[4-[(2-phenylmethoxyphenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(3-nitrophenyl)-2-[4-[(2-phenylmethoxyphenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-[(2-benzyloxyphenyl)methyl]piperazin-1-yl]-N-(3-nitrophenyl)acetamide CAS Name: N-(3-nitrophenyl)-2-[4-[(2-phenylmethoxyphenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(3-nitrophenyl)-2-[4-[(2-phenylmethoxyphenyl)methyl]piperazin-1-yl]acetamide Traditional Name: 2-[4-(2-benzoxybenzyl)piperazino]-N-(3-nitrophenyl)acetamide Formula: C26H28N4O4 MolecularWeight: 460.52492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2OCC3=CC=CC=C3)CC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2OCC3=CC=CC=C3)CC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H28N4O4/c31-26(27-23-10-6-11-24(17-23)30(32)33)19-29-15-13-28(14-16-29)18-22-9-4-5-12-25(22)34-20-21-7-2-1-3-8-21/h1-12,17H,13-16,18-20H2,(H,27,31)