3-nitro-N-[4-(4-pentanoylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 3-nitro-N-[4-(4-pentanoylpiperazin-1-yl)phenyl]benzamide Openeye Name: 3-nitro-N-[4-(4-pentanoylpiperazin-1-yl)phenyl]benzamide CAS Name: 3-nitro-N-[4-[4-(1-oxopentyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-nitro-N-[4-(4-pentanoylpiperazin-1-yl)phenyl]benzamide Traditional Name: 3-nitro-N-[4-(4-valerylpiperazino)phenyl]benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O4/c1-2-3-7-21(27)25-14-12-24(13-15-25)19-10-8-18(9-11-19)23-22(28)17-5-4-6-20(16-17)26(29)30/h4-6,8-11,16H,2-3,7,12-15H2,1H3,(H,23,28)