N-[4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[1-methyl-3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxo-propyl]benzamide CAS Name: N-[4-[4-(4-nitrophenyl)-1-piperazinyl]-4-oxobutan-2-yl]benzamide IUPAC Name: N-[4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutan-2-yl]benzamide Traditional Name: N-[3-keto-1-methyl-3-[4-(4-nitrophenyl)piperazino]propyl]benzamide Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O4/c1-16(22-21(27)17-5-3-2-4-6-17)15-20(26)24-13-11-23(12-14-24)18-7-9-19(10-8-18)25(28)29/h2-10,16H,11-15H2,1H3,(H,22,27)