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

Systemtic Name: N-(furan-2-ylmethyl)-N-[(3-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-(2-furylmethyl)-N-[(3-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-(2-furanylmethyl)-N-[(3-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-(furan-2-ylmethyl)-N-[(3-nitrophenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-(2-furfuryl)-N-(3-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(=CC=C3)[N+](=O)[O-])CC4=CC=CO4

Isomeric SMILES

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

InChI

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