1-[4-[4-(2-methoxyphenyl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]-3-methyl-phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: 1-[4-[4-(2-methoxyphenyl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]-3-methyl-phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-[4-[1-carboxy-3-(2-methoxyphenyl)propyl]-3-methyl-phenyl]sulfonylindoline-2-carboxylic acid CAS Name: 1-[4-[1-hydroxy-4-(2-methoxyphenyl)-1-oxobutan-2-yl]-3-methylphenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-[4-[1-hydroxy-4-(2-methoxyphenyl)-1-oxobutan-2-yl]-3-methylphenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-[4-[1-carboxy-3-(2-methoxyphenyl)propyl]-3-methyl-phenyl]sulfonylindoline-2-carboxylic acid Formula: C27H27NO7S MolecularWeight: 509.57078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2C(CC3=CC=CC=C32)C(=O)O)C(CCC4=CC=CC=C4OC)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2C(CC3=CC=CC=C32)C(=O)O)C(CCC4=CC=CC=C4OC)C(=O)O

InChI

InChI=1S/C27H27NO7S/c1-17-15-20(36(33,34)28-23-9-5-3-8-19(23)16-24(28)27(31)32)12-14-21(17)22(26(29)30)13-11-18-7-4-6-10-25(18)35-2/h3-10,12,14-15,22,24H,11,13,16H2,1-2H3,(H,29,30)(H,31,32)