N-(2-methyl-6-propan-2-yl-phenyl)-2-nitro-benzenesulfonamide

Systemtic Name: N-(2-methyl-6-propan-2-yl-phenyl)-2-nitro-benzenesulfonamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-2-nitro-benzenesulfonamide CAS Name: N-(2-methyl-6-propan-2-ylphenyl)-2-nitrobenzenesulfonamide IUPAC Name: N-(2-methyl-6-propan-2-ylphenyl)-2-nitrobenzenesulfonamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-2-nitro-benzenesulfonamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4S/c1-11(2)13-8-6-7-12(3)16(13)17-23(21,22)15-10-5-4-9-14(15)18(19)20/h4-11,17H,1-3H3