N-(4-methyl-3-nitro-phenyl)-4-propan-2-yl-benzenesulfonamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-4-propan-2-yl-benzenesulfonamide Openeye Name: 4-isopropyl-N-(4-methyl-3-nitro-phenyl)benzenesulfonamide CAS Name: N-(4-methyl-3-nitrophenyl)-4-propan-2-ylbenzenesulfonamide IUPAC Name: N-(4-methyl-3-nitrophenyl)-4-propan-2-ylbenzenesulfonamide Traditional Name: 4-isopropyl-N-(4-methyl-3-nitro-phenyl)benzenesulfonamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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