3-nitro-N-[2-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1-benzofuran-3-yl]benzamide

Systemtic Name: 3-nitro-N-[2-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1-benzofuran-3-yl]benzamide Openeye Name: N-[2-(4-benzylpiperazine-1-carbonyl)benzofuran-3-yl]-3-nitro-benzamide CAS Name: 3-nitro-N-[2-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-3-benzofuranyl]benzamide IUPAC Name: N-[2-(4-benzylpiperazine-1-carbonyl)-1-benzofuran-3-yl]-3-nitrobenzamide Traditional Name: N-[2-(4-benzylpiperazine-1-carbonyl)benzofuran-3-yl]-3-nitro-benzamide Formula: C27H24N4O5 MolecularWeight: 484.50326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4O3)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4O3)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H24N4O5/c32-26(20-9-6-10-21(17-20)31(34)35)28-24-22-11-4-5-12-23(22)36-25(24)27(33)30-15-13-29(14-16-30)18-19-7-2-1-3-8-19/h1-12,17H,13-16,18H2,(H,28,32)