4,6-bis(chloranyl)-3-methyl-5-(4-oxidanyl-3-propan-2-yl-phenoxy)-1H-indole-2-carboxylic acid

Systemtic Name: 4,6-bis(chloranyl)-3-methyl-5-(4-oxidanyl-3-propan-2-yl-phenoxy)-1H-indole-2-carboxylic acid Openeye Name: 4,6-dichloro-5-(4-hydroxy-3-isopropyl-phenoxy)-3-methyl-1H-indole-2-carboxylic acid CAS Name: 4,6-dichloro-5-(4-hydroxy-3-propan-2-ylphenoxy)-3-methyl-1H-indole-2-carboxylic acid IUPAC Name: 4,6-dichloro-5-(4-hydroxy-3-propan-2-ylphenoxy)-3-methyl-1H-indole-2-carboxylic acid Traditional Name: 4,6-dichloro-5-(4-hydroxy-3-isopropyl-phenoxy)-3-methyl-1H-indole-2-carboxylic acid Formula: C19H17Cl2NO4 MolecularWeight: 394.24858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=CC(=C(C(=C12)Cl)OC3=CC(=C(C=C3)O)C(C)C)Cl)C(=O)O

Isomeric SMILES

CC1=C(NC2=CC(=C(C(=C12)Cl)OC3=CC(=C(C=C3)O)C(C)C)Cl)C(=O)O

InChI

InChI=1S/C19H17Cl2NO4/c1-8(2)11-6-10(4-5-14(11)23)26-18-12(20)7-13-15(16(18)21)9(3)17(22-13)19(24)25/h4-8,22-23H,1-3H3,(H,24,25)