N-[3-methyl-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanylidene-pentan-2-yl]benzamide

Systemtic Name: N-[3-methyl-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanylidene-pentan-2-yl]benzamide Openeye Name: N-[2-methyl-1-[4-(4-nitrophenyl)piperazine-1-carbonyl]butyl]benzamide CAS Name: N-[3-methyl-1-[4-(4-nitrophenyl)-1-piperazinyl]-1-oxopentan-2-yl]benzamide IUPAC Name: N-[3-methyl-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxopentan-2-yl]benzamide Traditional Name: N-[2-methyl-1-[4-(4-nitrophenyl)piperazine-1-carbonyl]butyl]benzamide Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O4/c1-3-17(2)21(24-22(28)18-7-5-4-6-8-18)23(29)26-15-13-25(14-16-26)19-9-11-20(12-10-19)27(30)31/h4-12,17,21H,3,13-16H2,1-2H3,(H,24,28)