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

Systemtic Name: N-(furan-2-ylmethyl)-N-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-(2-furylmethyl)-N-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-(2-furanylmethyl)-N-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-(furan-2-ylmethyl)-N-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-(2-furfuryl)-N-(4-nitrobenzyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C20H18N2O7S MolecularWeight: 430.43112

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)N(CC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CO4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)N(CC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CO4

InChI

InChI=1S/C20H18N2O7S/c23-22(24)16-5-3-15(4-6-16)13-21(14-17-2-1-9-27-17)30(25,26)18-7-8-19-20(12-18)29-11-10-28-19/h1-9,12H,10-11,13-14H2