2-(2-nitrophenyl)-N-[3-(3-oxidanylidenepiperazin-1-yl)sulfonylphenyl]ethanamide

Systemtic Name: 2-(2-nitrophenyl)-N-[3-(3-oxidanylidenepiperazin-1-yl)sulfonylphenyl]ethanamide Openeye Name: 2-(2-nitrophenyl)-N-[3-(3-oxopiperazin-1-yl)sulfonylphenyl]acetamide CAS Name: 2-(2-nitrophenyl)-N-[3-[(3-oxo-1-piperazinyl)sulfonyl]phenyl]acetamide IUPAC Name: 2-(2-nitrophenyl)-N-[3-(3-oxopiperazin-1-yl)sulfonylphenyl]acetamide Traditional Name: N-[3-(3-ketopiperazino)sulfonylphenyl]-2-(2-nitrophenyl)acetamide Formula: C18H18N4O6S MolecularWeight: 418.42372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O6S/c23-17(10-13-4-1-2-7-16(13)22(25)26)20-14-5-3-6-15(11-14)29(27,28)21-9-8-19-18(24)12-21/h1-7,11H,8-10,12H2,(H,19,24)(H,20,23)