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

Systemtic Name: 4,6-bis(chloranyl)-5-[4-oxidanyl-3-(propan-2-ylcarbamoyl)phenoxy]-1H-indole-2-carboxylic acid Openeye Name: 4,6-dichloro-5-[4-hydroxy-3-(isopropylcarbamoyl)phenoxy]-1H-indole-2-carboxylic acid CAS Name: 4,6-dichloro-5-[4-hydroxy-3-[oxo-(propan-2-ylamino)methyl]phenoxy]-1H-indole-2-carboxylic acid IUPAC Name: 4,6-dichloro-5-[4-hydroxy-3-(propan-2-ylcarbamoyl)phenoxy]-1H-indole-2-carboxylic acid Traditional Name: 4,6-dichloro-5-[4-hydroxy-3-(isopropylcarbamoyl)phenoxy]-1H-indole-2-carboxylic acid Formula: C19H16Cl2N2O5 MolecularWeight: 423.24674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=C(C=CC(=C1)OC2=C(C=C3C(=C2Cl)C=C(N3)C(=O)O)Cl)O

Isomeric SMILES

CC(C)NC(=O)C1=C(C=CC(=C1)OC2=C(C=C3C(=C2Cl)C=C(N3)C(=O)O)Cl)O

InChI

InChI=1S/C19H16Cl2N2O5/c1-8(2)22-18(25)11-5-9(3-4-15(11)24)28-17-12(20)7-13-10(16(17)21)6-14(23-13)19(26)27/h3-8,23-24H,1-2H3,(H,22,25)(H,26,27)