2-[(5-carboxy-2-methoxy-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid

Systemtic Name: 2-[(5-carboxy-2-methoxy-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid Openeye Name: 2-[(5-carboxy-2-methoxy-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid CAS Name: 2-[(5-carboxy-2-methoxyphenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid IUPAC Name: 2-[(5-carboxy-2-methoxyphenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid Traditional Name: 2-[(5-carboxy-2-methoxy-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid Formula: C19H21NO10S MolecularWeight: 455.43574

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C(=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)OC)C(=O)O)OC

Isomeric SMILES

COCCOC1=C(C=C(C(=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)OC)C(=O)O)OC

InChI

InChI=1S/C19H21NO10S/c1-27-6-7-30-16-10-13(12(19(23)24)9-15(16)29-3)20-31(25,26)17-8-11(18(21)22)4-5-14(17)28-2/h4-5,8-10,20H,6-7H2,1-3H3,(H,21,22)(H,23,24)