4-[bis(fluoranyl)methoxy]-2-[(4-ethoxycarbonylphenyl)sulfonylamino]-5-methoxy-benzoic acid

Systemtic Name: 4-[bis(fluoranyl)methoxy]-2-[(4-ethoxycarbonylphenyl)sulfonylamino]-5-methoxy-benzoic acid Openeye Name: 4-(difluoromethoxy)-2-[(4-ethoxycarbonylphenyl)sulfonylamino]-5-methoxy-benzoic acid CAS Name: 4-(difluoromethoxy)-2-[(4-ethoxycarbonylphenyl)sulfonylamino]-5-methoxybenzoic acid IUPAC Name: 4-(difluoromethoxy)-2-[(4-ethoxycarbonylphenyl)sulfonylamino]-5-methoxybenzoic acid Traditional Name: 2-[(4-carbethoxyphenyl)sulfonylamino]-4-(difluoromethoxy)-5-methoxy-benzoic acid Formula: C18H17F2NO8S MolecularWeight: 445.391286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2C(=O)O)OC)OC(F)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2C(=O)O)OC)OC(F)F

InChI

InChI=1S/C18H17F2NO8S/c1-3-28-17(24)10-4-6-11(7-5-10)30(25,26)21-13-9-15(29-18(19)20)14(27-2)8-12(13)16(22)23/h4-9,18,21H,3H2,1-2H3,(H,22,23)