N-[3-(4-methylpyrazol-1-yl)propyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[3-(4-methylpyrazol-1-yl)propyl]-4-nitro-benzenesulfonamide Openeye Name: N-[3-(4-methylpyrazol-1-yl)propyl]-4-nitro-benzenesulfonamide CAS Name: N-[3-(4-methyl-1-pyrazolyl)propyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[3-(4-methylpyrazol-1-yl)propyl]-4-nitrobenzenesulfonamide Traditional Name: N-[3-(4-methylpyrazol-1-yl)propyl]-4-nitro-benzenesulfonamide Formula: C13H16N4O4S MolecularWeight: 324.35554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1)CCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CN(N=C1)CCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O4S/c1-11-9-14-16(10-11)8-2-7-15-22(20,21)13-5-3-12(4-6-13)17(18)19/h3-6,9-10,15H,2,7-8H2,1H3