methyl 5-[[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(4-methylphenyl)amino]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(4-methylphenyl)amino]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methyl-anilino]methyl]furan-2-carboxylate CAS Name: 5-[[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methylanilino]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methylanilino]methyl]furan-2-carboxylate Traditional Name: 5-[[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methyl-anilino]methyl]furan-2-carboxylic acid methyl ester Formula: C22H21NO7S MolecularWeight: 443.46964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC2=CC=C(O2)C(=O)OC)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=C(C=C1)N(CC2=CC=C(O2)C(=O)OC)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H21NO7S/c1-15-3-5-16(6-4-15)23(14-17-7-9-20(30-17)22(24)27-2)31(25,26)18-8-10-19-21(13-18)29-12-11-28-19/h3-10,13H,11-12,14H2,1-2H3