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

Systemtic Name: N-(furan-2-ylmethyl)-N-[(3-methylphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-(2-furylmethyl)-N-(m-tolylmethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-(2-furanylmethyl)-N-[(3-methylphenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-(furan-2-ylmethyl)-N-[(3-methylphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-(2-furfuryl)-N-(3-methylbenzyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN(CC2=CC=CO2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC(=CC=C1)CN(CC2=CC=CO2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H21NO5S/c1-16-4-2-5-17(12-16)14-22(15-18-6-3-9-25-18)28(23,24)19-7-8-20-21(13-19)27-11-10-26-20/h2-9,12-13H,10-11,14-15H2,1H3