N-[4-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]phenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[4-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]phenyl]-3,5-dinitro-benzamide Openeye Name: N-[4-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]phenyl]-3,5-dinitro-benzamide CAS Name: N-[4-[4-(3-cyclopentyl-1-oxopropyl)-1-piperazinyl]phenyl]-3,5-dinitrobenzamide IUPAC Name: N-[4-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]phenyl]-3,5-dinitrobenzamide Traditional Name: N-[4-[4-(3-cyclopentylpropanoyl)piperazino]phenyl]-3,5-dinitro-benzamide Formula: C25H29N5O6 MolecularWeight: 495.52766

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)CCC(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C25H29N5O6/c31-24(10-5-18-3-1-2-4-18)28-13-11-27(12-14-28)21-8-6-20(7-9-21)26-25(32)19-15-22(29(33)34)17-23(16-19)30(35)36/h6-9,15-18H,1-5,10-14H2,(H,26,32)