N-[3-(3-methoxy-4-nitro-pyrazol-1-yl)propyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide

Systemtic Name: N-[3-(3-methoxy-4-nitro-pyrazol-1-yl)propyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide Openeye Name: N-[3-(3-methoxy-4-nitro-pyrazol-1-yl)propyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide CAS Name: N-[3-(3-methoxy-4-nitro-1-pyrazolyl)propyl]-4-(2-oxo-1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-[3-(3-methoxy-4-nitropyrazol-1-yl)propyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide Traditional Name: 4-(2-ketopyrrolidino)-N-[3-(3-methoxy-4-nitro-pyrazol-1-yl)propyl]benzenesulfonamide Formula: C17H21N5O6S MolecularWeight: 423.44354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C=C1[N+](=O)[O-])CCCNS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

COC1=NN(C=C1[N+](=O)[O-])CCCNS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C17H21N5O6S/c1-28-17-15(22(24)25)12-20(19-17)10-3-9-18-29(26,27)14-7-5-13(6-8-14)21-11-2-4-16(21)23/h5-8,12,18H,2-4,9-11H2,1H3