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

Systemtic Name: 3-[2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]-1-ethyl-indole-2-carboxylic acid Openeye Name: 3-[2-(5-chloro-2,4-dimethoxy-anilino)-2-oxo-ethyl]-1-ethyl-indole-2-carboxylic acid CAS Name: 3-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-1-ethyl-2-indolecarboxylic acid IUPAC Name: 3-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-1-ethylindole-2-carboxylic acid Traditional Name: 3-[2-(5-chloro-2,4-dimethoxy-anilino)-2-keto-ethyl]-1-ethyl-indole-2-carboxylic acid Formula: C21H21ClN2O5 MolecularWeight: 416.85484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)NC3=CC(=C(C=C3OC)OC)Cl

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)NC3=CC(=C(C=C3OC)OC)Cl

InChI

InChI=1S/C21H21ClN2O5/c1-4-24-16-8-6-5-7-12(16)13(20(24)21(26)27)9-19(25)23-15-10-14(22)17(28-2)11-18(15)29-3/h5-8,10-11H,4,9H2,1-3H3,(H,23,25)(H,26,27)