3-[(4-fluoranyl-3-methyl-phenyl)sulfonylamino]-5,6-dimethoxy-1H-indole-2-carboxylic acid

Systemtic Name: 3-[(4-fluoranyl-3-methyl-phenyl)sulfonylamino]-5,6-dimethoxy-1H-indole-2-carboxylic acid Openeye Name: 3-[(4-fluoro-3-methyl-phenyl)sulfonylamino]-5,6-dimethoxy-1H-indole-2-carboxylic acid CAS Name: 3-[(4-fluoro-3-methylphenyl)sulfonylamino]-5,6-dimethoxy-1H-indole-2-carboxylic acid IUPAC Name: 3-[(4-fluoro-3-methylphenyl)sulfonylamino]-5,6-dimethoxy-1H-indole-2-carboxylic acid Traditional Name: 3-[(4-fluoro-3-methyl-phenyl)sulfonylamino]-5,6-dimethoxy-1H-indole-2-carboxylic acid Formula: C18H17FN2O6S MolecularWeight: 408.400783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NC2=C(NC3=CC(=C(C=C32)OC)OC)C(=O)O)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NC2=C(NC3=CC(=C(C=C32)OC)OC)C(=O)O)F

InChI

InChI=1S/C18H17FN2O6S/c1-9-6-10(4-5-12(9)19)28(24,25)21-16-11-7-14(26-2)15(27-3)8-13(11)20-17(16)18(22)23/h4-8,20-21H,1-3H3,(H,22,23)