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

Systemtic Name: N-[3-chloranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chloro-phenyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)-3-chlorophenyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chlorophenyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[4-(4-benzoylpiperazino)-3-chloro-phenyl]-4-ethoxy-3-nitro-benzamide Formula: C26H25ClN4O5 MolecularWeight: 508.9535

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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)Cl)[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)Cl)[N+](=O)[O-]

InChI

InChI=1S/C26H25ClN4O5/c1-2-36-24-11-8-19(16-23(24)31(34)35)25(32)28-20-9-10-22(21(27)17-20)29-12-14-30(15-13-29)26(33)18-6-4-3-5-7-18/h3-11,16-17H,2,12-15H2,1H3,(H,28,32)