N-methyl-N-[(3-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-methyl-N-[(3-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-methyl-N-[(3-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-methyl-N-[(3-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-methyl-N-[(3-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-methyl-N-(3-nitrobenzyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C16H16N2O6S MolecularWeight: 364.37304

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)[N+](=O)[O-])S(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CN(CC1=CC(=CC=C1)[N+](=O)[O-])S(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H16N2O6S/c1-17(11-12-3-2-4-13(9-12)18(19)20)25(21,22)14-5-6-15-16(10-14)24-8-7-23-15/h2-6,9-10H,7-8,11H2,1H3