1-[2-(4-chloranyl-3-oxidanyl-phenyl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]-2-methyl-indole-3-carboxylic acid

Systemtic Name: 1-[2-(4-chloranyl-3-oxidanyl-phenyl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]-2-methyl-indole-3-carboxylic acid Openeye Name: 1-[1-(4-chloro-3-hydroxy-phenyl)-2-hydroxy-1-methyl-2-oxo-ethyl]-2-methyl-indole-3-carboxylic acid CAS Name: 1-[2-(4-chloro-3-hydroxyphenyl)-1-hydroxy-1-oxopropan-2-yl]-2-methyl-3-indolecarboxylic acid IUPAC Name: 1-[2-(4-chloro-3-hydroxyphenyl)-1-hydroxy-1-oxopropan-2-yl]-2-methylindole-3-carboxylic acid Traditional Name: 1-[1-(4-chloro-3-hydroxy-phenyl)-2-hydroxy-2-keto-1-methyl-ethyl]-2-methyl-indole-3-carboxylic acid Formula: C19H16ClNO5 MolecularWeight: 373.78704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C(C)(C3=CC(=C(C=C3)Cl)O)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C(C)(C3=CC(=C(C=C3)Cl)O)C(=O)O)C(=O)O

InChI

InChI=1S/C19H16ClNO5/c1-10-16(17(23)24)12-5-3-4-6-14(12)21(10)19(2,18(25)26)11-7-8-13(20)15(22)9-11/h3-9,22H,1-2H3,(H,23,24)(H,25,26)