2-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]benzenesulfonamide

Systemtic Name: 2-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]benzenesulfonamide Openeye Name: 2-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]benzenesulfonamide CAS Name: 2-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]benzenesulfonamide IUPAC Name: 2-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]benzenesulfonamide Traditional Name: 2-nitro-N-(3,4,5-trimethoxybenzyl)benzenesulfonamide Formula: C16H18N2O7S MolecularWeight: 382.38832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O7S/c1-23-13-8-11(9-14(24-2)16(13)25-3)10-17-26(21,22)15-7-5-4-6-12(15)18(19)20/h4-9,17H,10H2,1-3H3