2-nitro-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide

Systemtic Name: 2-nitro-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide Openeye Name: N-[(4-isopropoxyphenyl)methyl]-2-nitro-benzenesulfonamide CAS Name: 2-nitro-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide IUPAC Name: 2-nitro-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide Traditional Name: N-(4-isopropoxybenzyl)-2-nitro-benzenesulfonamide Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O5S/c1-12(2)23-14-9-7-13(8-10-14)11-17-24(21,22)16-6-4-3-5-15(16)18(19)20/h3-10,12,17H,11H2,1-2H3