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

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-2-nitro-benzenesulfonamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-2-nitro-benzenesulfonamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-2-nitrobenzenesulfonamide Traditional Name: N-(3,4-diethoxybenzyl)-2-nitro-benzenesulfonamide Formula: C17H20N2O6S MolecularWeight: 380.4155

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])OCC

InChI

InChI=1S/C17H20N2O6S/c1-3-24-15-10-9-13(11-16(15)25-4-2)12-18-26(22,23)17-8-6-5-7-14(17)19(20)21/h5-11,18H,3-4,12H2,1-2H3