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

Systemtic Name: 3-[2-[(5-chloranyl-2,4-dimethoxy-phenyl)-methyl-amino]-2-oxidanylidene-ethyl]-1-ethyl-indole-2-carboxylic acid Openeye Name: 3-[2-(5-chloro-2,4-dimethoxy-N-methyl-anilino)-2-oxo-ethyl]-1-ethyl-indole-2-carboxylic acid CAS Name: 3-[2-(5-chloro-2,4-dimethoxy-N-methylanilino)-2-oxoethyl]-1-ethyl-2-indolecarboxylic acid IUPAC Name: 3-[2-(5-chloro-2,4-dimethoxy-N-methylanilino)-2-oxoethyl]-1-ethylindole-2-carboxylic acid Traditional Name: 3-[2-(5-chloro-2,4-dimethoxy-N-methyl-anilino)-2-keto-ethyl]-1-ethyl-indole-2-carboxylic acid Formula: C22H23ClN2O5 MolecularWeight: 430.88142

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)N(C)C3=CC(=C(C=C3OC)OC)Cl

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)N(C)C3=CC(=C(C=C3OC)OC)Cl

InChI

InChI=1S/C22H23ClN2O5/c1-5-25-16-9-7-6-8-13(16)14(21(25)22(27)28)10-20(26)24(2)17-11-15(23)18(29-3)12-19(17)30-4/h6-9,11-12H,5,10H2,1-4H3,(H,27,28)