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

Systemtic Name: 3-nitro-N-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[4-(4-benzoylpiperazino)phenyl]-3-nitro-4-pyrrolidino-benzamide Formula: C28H29N5O4 MolecularWeight: 499.56096

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H29N5O4/c34-27(22-8-13-25(26(20-22)33(36)37)31-14-4-5-15-31)29-23-9-11-24(12-10-23)30-16-18-32(19-17-30)28(35)21-6-2-1-3-7-21/h1-3,6-13,20H,4-5,14-19H2,(H,29,34)