3-[2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]-1-methyl-indole-2-carboxylic acid

Systemtic Name: 3-[2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]-1-methyl-indole-2-carboxylic acid Openeye Name: 3-[2-(5-chloro-2,4-dimethoxy-anilino)-2-oxo-ethyl]-1-methyl-indole-2-carboxylic acid CAS Name: 3-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-1-methyl-2-indolecarboxylic acid IUPAC Name: 3-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-1-methylindole-2-carboxylic acid Traditional Name: 3-[2-(5-chloro-2,4-dimethoxy-anilino)-2-keto-ethyl]-1-methyl-indole-2-carboxylic acid Formula: C20H19ClN2O5 MolecularWeight: 402.82826

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)NC3=CC(=C(C=C3OC)OC)Cl

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)NC3=CC(=C(C=C3OC)OC)Cl

InChI

InChI=1S/C20H19ClN2O5/c1-23-15-7-5-4-6-11(15)12(19(23)20(25)26)8-18(24)22-14-9-13(21)16(27-2)10-17(14)28-3/h4-7,9-10H,8H2,1-3H3,(H,22,24)(H,25,26)