[2-[(2-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-(4-ethanoylphenoxy)butanoate

Systemtic Name: [2-[(2-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-(4-ethanoylphenoxy)butanoate Openeye Name: [2-(2-chloro-4-methyl-anilino)-2-oxo-ethyl] 4-(4-acetylphenoxy)butanoate CAS Name: 4-(4-acetylphenoxy)butanoic acid [2-(2-chloro-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-4-methylanilino)-2-oxoethyl] 4-(4-acetylphenoxy)butanoate Traditional Name: 4-(4-acetylphenoxy)butyric acid [2-(2-chloro-4-methyl-anilino)-2-keto-ethyl] ester Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClNO5/c1-14-5-10-19(18(22)12-14)23-20(25)13-28-21(26)4-3-11-27-17-8-6-16(7-9-17)15(2)24/h5-10,12H,3-4,11,13H2,1-2H3,(H,23,25)