N-(1,3-benzodioxol-5-yl)-4-methylsulfonyl-3-nitro-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-methylsulfonyl-3-nitro-benzamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-methylsulfonyl-3-nitro-benzamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-methylsulfonyl-3-nitrobenzamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-methylsulfonyl-3-nitrobenzamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-mesyl-3-nitro-benzamide Formula: C15H12N2O7S MolecularWeight: 364.32998

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O7S/c1-25(21,22)14-5-2-9(6-11(14)17(19)20)15(18)16-10-3-4-12-13(7-10)24-8-23-12/h2-7H,8H2,1H3,(H,16,18)