2-nitro-N-[(2-propan-2-ylphenyl)methyl]benzenesulfonamide

Systemtic Name: 2-nitro-N-[(2-propan-2-ylphenyl)methyl]benzenesulfonamide Openeye Name: N-[(2-isopropylphenyl)methyl]-2-nitro-benzenesulfonamide CAS Name: 2-nitro-N-[(2-propan-2-ylphenyl)methyl]benzenesulfonamide IUPAC Name: 2-nitro-N-[(2-propan-2-ylphenyl)methyl]benzenesulfonamide Traditional Name: N-(2-isopropylbenzyl)-2-nitro-benzenesulfonamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O4S/c1-12(2)14-8-4-3-7-13(14)11-17-23(21,22)16-10-6-5-9-15(16)18(19)20/h3-10,12,17H,11H2,1-2H3