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

Systemtic Name: N-(4-methoxyphenyl)-N-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-(4-methoxyphenyl)-N-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-(4-methoxyphenyl)-N-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-(4-methoxyphenyl)-N-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-(4-methoxyphenyl)-N-(4-nitrobenzyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C22H20N2O7S MolecularWeight: 456.4684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=CC=C(C=C1)N(CC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H20N2O7S/c1-29-19-8-6-17(7-9-19)23(15-16-2-4-18(5-3-16)24(25)26)32(27,28)20-10-11-21-22(14-20)31-13-12-30-21/h2-11,14H,12-13,15H2,1H3