3-[(3,4-dichlorophenyl)methyl]-4-(1-oxidanyl-1-oxidanylidene-propan-2-yl)oxy-1H-indole-2-carboxylic acid

Systemtic Name: 3-[(3,4-dichlorophenyl)methyl]-4-(1-oxidanyl-1-oxidanylidene-propan-2-yl)oxy-1H-indole-2-carboxylic acid Openeye Name: 3-[(3,4-dichlorophenyl)methyl]-4-(2-hydroxy-1-methyl-2-oxo-ethoxy)-1H-indole-2-carboxylic acid CAS Name: 3-[(3,4-dichlorophenyl)methyl]-4-(1-hydroxy-1-oxopropan-2-yl)oxy-1H-indole-2-carboxylic acid IUPAC Name: 3-[(3,4-dichlorophenyl)methyl]-4-(1-hydroxy-1-oxopropan-2-yl)oxy-1H-indole-2-carboxylic acid Traditional Name: 3-(3,4-dichlorobenzyl)-4-(2-hydroxy-2-keto-1-methyl-ethoxy)-1H-indole-2-carboxylic acid Formula: C19H15Cl2NO5 MolecularWeight: 408.2321

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=CC2=C1C(=C(N2)C(=O)O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C(=O)O)OC1=CC=CC2=C1C(=C(N2)C(=O)O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H15Cl2NO5/c1-9(18(23)24)27-15-4-2-3-14-16(15)11(17(22-14)19(25)26)7-10-5-6-12(20)13(21)8-10/h2-6,8-9,22H,7H2,1H3,(H,23,24)(H,25,26)