N-heptyl-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-heptyl-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-heptyl-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-heptyl-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-heptyl-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-heptyl-4-methyl-3-nitro-benzenesulfonamide Formula: C14H22N2O4S MolecularWeight: 314.40048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNS(=O)(=O)C1=CC(=C(C=C1)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCNS(=O)(=O)C1=CC(=C(C=C1)C)[N+](=O)[O-]

InChI

InChI=1S/C14H22N2O4S/c1-3-4-5-6-7-10-15-21(19,20)13-9-8-12(2)14(11-13)16(17)18/h8-9,11,15H,3-7,10H2,1-2H3