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

Systemtic Name: 3-[2-[(5-chloranyl-2-methoxy-phenyl)-methyl-amino]-2-oxidanylidene-ethyl]-1-methyl-indole-2-carboxylic acid Openeye Name: 3-[2-(5-chloro-2-methoxy-N-methyl-anilino)-2-oxo-ethyl]-1-methyl-indole-2-carboxylic acid CAS Name: 3-[2-(5-chloro-2-methoxy-N-methylanilino)-2-oxoethyl]-1-methyl-2-indolecarboxylic acid IUPAC Name: 3-[2-(5-chloro-2-methoxy-N-methylanilino)-2-oxoethyl]-1-methylindole-2-carboxylic acid Traditional Name: 3-[2-(5-chloro-2-methoxy-N-methyl-anilino)-2-keto-ethyl]-1-methyl-indole-2-carboxylic acid Formula: C20H19ClN2O4 MolecularWeight: 386.82886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)N(C)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)N(C)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H19ClN2O4/c1-22(16-10-12(21)8-9-17(16)27-3)18(24)11-14-13-6-4-5-7-15(13)23(2)19(14)20(25)26/h4-10H,11H2,1-3H3,(H,25,26)