5-[[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]methyl]furan-2-carboxylic acid Openeye Name: 5-[[benzyl-(4-methoxyphenyl)sulfonyl-amino]methyl]furan-2-carboxylic acid CAS Name: 5-[[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[benzyl-(4-methoxyphenyl)sulfonylamino]methyl]furan-2-carboxylic acid Traditional Name: 5-[[benzyl-(4-methoxyphenyl)sulfonyl-amino]methyl]-2-furoic acid Formula: C20H19NO6S MolecularWeight: 401.43296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC3=CC=C(O3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC3=CC=C(O3)C(=O)O

InChI

InChI=1S/C20H19NO6S/c1-26-16-7-10-18(11-8-16)28(24,25)21(13-15-5-3-2-4-6-15)14-17-9-12-19(27-17)20(22)23/h2-12H,13-14H2,1H3,(H,22,23)