N-cyclopropyl-2-methyl-N-(2-methylpropyl)-5-nitro-benzenesulfonamide

Systemtic Name: N-cyclopropyl-2-methyl-N-(2-methylpropyl)-5-nitro-benzenesulfonamide Openeye Name: N-cyclopropyl-N-isobutyl-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-cyclopropyl-2-methyl-N-(2-methylpropyl)-5-nitrobenzenesulfonamide IUPAC Name: N-cyclopropyl-2-methyl-N-(2-methylpropyl)-5-nitrobenzenesulfonamide Traditional Name: N-cyclopropyl-N-isobutyl-2-methyl-5-nitro-benzenesulfonamide Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(CC(C)C)C2CC2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(CC(C)C)C2CC2

InChI

InChI=1S/C14H20N2O4S/c1-10(2)9-15(12-6-7-12)21(19,20)14-8-13(16(17)18)5-4-11(14)3/h4-5,8,10,12H,6-7,9H2,1-3H3