3-(4-ethanoylpiperazin-1-yl)sulfonyl-N-methyl-N-[(3-nitrophenyl)methyl]benzamide

Systemtic Name: 3-(4-ethanoylpiperazin-1-yl)sulfonyl-N-methyl-N-[(3-nitrophenyl)methyl]benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-methyl-N-[(3-nitrophenyl)methyl]benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-methyl-N-[(3-nitrophenyl)methyl]benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-methyl-N-[(3-nitrophenyl)methyl]benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-methyl-N-(3-nitrobenzyl)benzamide Formula: C21H24N4O6S MolecularWeight: 460.50346

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N(C)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N(C)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O6S/c1-16(26)23-9-11-24(12-10-23)32(30,31)20-8-4-6-18(14-20)21(27)22(2)15-17-5-3-7-19(13-17)25(28)29/h3-8,13-14H,9-12,15H2,1-2H3