N-(6-ethanoyl-1,3-benzodioxol-5-yl)-4-methoxy-3-nitro-benzenesulfonamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-4-methoxy-3-nitro-benzenesulfonamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-4-methoxy-3-nitro-benzenesulfonamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-4-methoxy-3-nitrobenzenesulfonamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-4-methoxy-3-nitrobenzenesulfonamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-4-methoxy-3-nitro-benzenesulfonamide Formula: C16H14N2O8S MolecularWeight: 394.35596

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NS(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NS(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])OCO2

InChI

InChI=1S/C16H14N2O8S/c1-9(19)11-6-15-16(26-8-25-15)7-12(11)17-27(22,23)10-3-4-14(24-2)13(5-10)18(20)21/h3-7,17H,8H2,1-2H3