[2-[(2-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-(3,5-dimethoxyphenyl)propanoate

Systemtic Name: [2-[(2-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-(3,5-dimethoxyphenyl)propanoate Openeye Name: [2-(2-chloro-4-methyl-anilino)-2-oxo-ethyl] 3-(3,5-dimethoxyphenyl)propanoate CAS Name: 3-(3,5-dimethoxyphenyl)propanoic acid [2-(2-chloro-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-4-methylanilino)-2-oxoethyl] 3-(3,5-dimethoxyphenyl)propanoate Traditional Name: 3-(3,5-dimethoxyphenyl)propionic acid [2-(2-chloro-4-methyl-anilino)-2-keto-ethyl] ester Formula: C20H22ClNO5 MolecularWeight: 391.84538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)CCC2=CC(=CC(=C2)OC)OC)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)CCC2=CC(=CC(=C2)OC)OC)Cl

InChI

InChI=1S/C20H22ClNO5/c1-13-4-6-18(17(21)8-13)22-19(23)12-27-20(24)7-5-14-9-15(25-2)11-16(10-14)26-3/h4,6,8-11H,5,7,12H2,1-3H3,(H,22,23)