[1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(2,5-dimethylphenoxy)propanoate

Systemtic Name: [1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(2,5-dimethylphenoxy)propanoate Openeye Name: [2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl] 3-(2,5-dimethylphenoxy)propanoate CAS Name: 3-(2,5-dimethylphenoxy)propanoic acid [1-(2-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-cyanoanilino)-1-oxopropan-2-yl] 3-(2,5-dimethylphenoxy)propanoate Traditional Name: 3-(2,5-dimethylphenoxy)propionic acid [2-(2-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCC(=O)OC(C)C(=O)NC2=CC=CC=C2C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCC(=O)OC(C)C(=O)NC2=CC=CC=C2C#N

InChI

InChI=1S/C21H22N2O4/c1-14-8-9-15(2)19(12-14)26-11-10-20(24)27-16(3)21(25)23-18-7-5-4-6-17(18)13-22/h4-9,12,16H,10-11H2,1-3H3,(H,23,25)