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

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

Systemtic Name:2-nitro-3-(3-pyrazol-1-ylpropyl)benzenesulfonamide
Openeye Name:2-nitro-3-(3-pyrazol-1-ylpropyl)benzenesulfonamide
CAS Name:2-nitro-3-[3-(1-pyrazolyl)propyl]benzenesulfonamide
IUPAC Name:2-nitro-3-(3-pyrazol-1-ylpropyl)benzenesulfonamide
Traditional Name:2-nitro-3-(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)S(=O)(=O)N)[N+](=O)[O-])CCCN2C=CC=N2


Isomeric SMILES

C1=CC(=C(C(=C1)S(=O)(=O)N)[N+](=O)[O-])CCCN2C=CC=N2


InChI

InChI=1S/C12H14N4O4S/c13-21(19,20)11-6-1-4-10(12(11)16(17)18)5-2-8-15-9-3-7-14-15/h1,3-4,6-7,9H,2,5,8H2,(H2,13,19,20)


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