4,6-bis(chloranyl)-5-[3-(cyclohexylcarbamoyl)-4-oxidanyl-phenoxy]-1H-indole-2-carboxylic acid

Systemtic Name: 4,6-bis(chloranyl)-5-[3-(cyclohexylcarbamoyl)-4-oxidanyl-phenoxy]-1H-indole-2-carboxylic acid Openeye Name: 4,6-dichloro-5-[3-(cyclohexylcarbamoyl)-4-hydroxy-phenoxy]-1H-indole-2-carboxylic acid CAS Name: 4,6-dichloro-5-[3-[(cyclohexylamino)-oxomethyl]-4-hydroxyphenoxy]-1H-indole-2-carboxylic acid IUPAC Name: 4,6-dichloro-5-[3-(cyclohexylcarbamoyl)-4-hydroxyphenoxy]-1H-indole-2-carboxylic acid Traditional Name: 4,6-dichloro-5-[3-(cyclohexylcarbamoyl)-4-hydroxy-phenoxy]-1H-indole-2-carboxylic acid Formula: C22H20Cl2N2O5 MolecularWeight: 463.3106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)OC3=C(C=C4C(=C3Cl)C=C(N4)C(=O)O)Cl)O

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)OC3=C(C=C4C(=C3Cl)C=C(N4)C(=O)O)Cl)O

InChI

InChI=1S/C22H20Cl2N2O5/c23-15-10-16-13(9-17(26-16)22(29)30)19(24)20(15)31-12-6-7-18(27)14(8-12)21(28)25-11-4-2-1-3-5-11/h6-11,26-27H,1-5H2,(H,25,28)(H,29,30)