[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] 4-(4-chloranyl-3-methyl-phenoxy)butanoate

Systemtic Name: [2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] 4-(4-chloranyl-3-methyl-phenoxy)butanoate Openeye Name: [2-(3-methylanilino)-2-oxo-ethyl] 4-(4-chloro-3-methyl-phenoxy)butanoate CAS Name: 4-(4-chloro-3-methylphenoxy)butanoic acid [2-(3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylanilino)-2-oxoethyl] 4-(4-chloro-3-methylphenoxy)butanoate Traditional Name: 4-(4-chloro-3-methyl-phenoxy)butyric acid [2-keto-2-(m-toluidino)ethyl] ester Formula: C20H22ClNO4 MolecularWeight: 375.84598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)COC(=O)CCCOC2=CC(=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)COC(=O)CCCOC2=CC(=C(C=C2)Cl)C

InChI

InChI=1S/C20H22ClNO4/c1-14-5-3-6-16(11-14)22-19(23)13-26-20(24)7-4-10-25-17-8-9-18(21)15(2)12-17/h3,5-6,8-9,11-12H,4,7,10,13H2,1-2H3,(H,22,23)