2-nitro-N-(3-pyrazol-1-ylpropyl)benzenesulfonamide

Systemtic Name: 2-nitro-N-(3-pyrazol-1-ylpropyl)benzenesulfonamide Openeye Name: 2-nitro-N-(3-pyrazol-1-ylpropyl)benzenesulfonamide CAS Name: 2-nitro-N-[3-(1-pyrazolyl)propyl]benzenesulfonamide IUPAC Name: 2-nitro-N-(3-pyrazol-1-ylpropyl)benzenesulfonamide Traditional Name: 2-nitro-N-(3-pyrazol-1-ylpropyl)benzenesulfonamide Formula: C12H14N4O4S MolecularWeight: 310.32896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NCCCN2C=CC=N2

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NCCCN2C=CC=N2

InChI

InChI=1S/C12H14N4O4S/c17-16(18)11-5-1-2-6-12(11)21(19,20)14-8-4-10-15-9-3-7-13-15/h1-3,5-7,9,14H,4,8,10H2