3,4-dimethyl-N-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3,4-dimethyl-N-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3,4-dimethyl-N-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]benzamide CAS Name: 3,4-dimethyl-N-[2-[4-(4-nitrophenyl)-1-piperazinyl]-2-oxoethyl]benzamide IUPAC Name: 3,4-dimethyl-N-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl]benzamide Traditional Name: N-[2-keto-2-[4-(4-nitrophenyl)piperazino]ethyl]-3,4-dimethyl-benzamide Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H24N4O4/c1-15-3-4-17(13-16(15)2)21(27)22-14-20(26)24-11-9-23(10-12-24)18-5-7-19(8-6-18)25(28)29/h3-8,13H,9-12,14H2,1-2H3,(H,22,27)