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

Systemtic Name: N-[4-(4-ethanoylpiperazin-1-yl)phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[4-(4-acetyl-1-piperazinyl)phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[4-(4-acetylpiperazino)phenyl]-4-methyl-3-nitro-benzamide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O4/c1-14-3-4-16(13-19(14)24(27)28)20(26)21-17-5-7-18(8-6-17)23-11-9-22(10-12-23)15(2)25/h3-8,13H,9-12H2,1-2H3,(H,21,26)