N-[3-[2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidin-1-yl]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidin-1-yl]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidin-1-yl]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[2-[2-(4-methylsulfonylphenyl)-1-oxoethyl]-1-pyrazolidinyl]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidin-1-yl]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-keto-3-[2-[2-(4-mesylphenyl)acetyl]pyrazolidin-1-yl]propyl]-4-nitro-benzamide Formula: C22H24N4O7S MolecularWeight: 488.51356

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CC(=O)N2CCCN2C(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CC(=O)N2CCCN2C(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O7S/c1-34(32,33)19-9-3-16(4-10-19)15-21(28)25-14-2-13-24(25)20(27)11-12-23-22(29)17-5-7-18(8-6-17)26(30)31/h3-10H,2,11-15H2,1H3,(H,23,29)