4-ethoxy-3-nitro-N-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]benzamide

Systemtic Name: 4-ethoxy-3-nitro-N-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]benzamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)phenyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[4-(4-benzoylpiperazino)phenyl]-4-ethoxy-3-nitro-benzamide Formula: C26H26N4O5 MolecularWeight: 474.50844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H26N4O5/c1-2-35-24-13-8-20(18-23(24)30(33)34)25(31)27-21-9-11-22(12-10-21)28-14-16-29(17-15-28)26(32)19-6-4-3-5-7-19/h3-13,18H,2,14-17H2,1H3,(H,27,31)