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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=CC2=C1C=C(N2CC3=CC(=C(C=C3)Cl)Cl)C(=O)O

Isomeric SMILES

CC(C(=O)O)OC1=CC=CC2=C1C=C(N2CC3=CC(=C(C=C3)Cl)Cl)C(=O)O

InChI

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