4-(1,3-benzodioxol-5-ylmethylamino)-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)-N-methyl-3-nitrobenzenesulfonamide Traditional Name: N-methyl-3-nitro-4-(piperonylamino)benzenesulfonamide Formula: C15H15N3O6S MolecularWeight: 365.3611

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O6S/c1-16-25(21,22)11-3-4-12(13(7-11)18(19)20)17-8-10-2-5-14-15(6-10)24-9-23-14/h2-7,16-17H,8-9H2,1H3