[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-(3-methylphenoxy)butanoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-(3-methylphenoxy)butanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 4-(3-methylphenoxy)butanoate CAS Name: 4-(3-methylphenoxy)butanoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 4-(3-methylphenoxy)butanoate Traditional Name: 4-(3-methylphenoxy)butyric acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)OCC(=O)NCCC#N

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C16H20N2O4/c1-13-5-2-6-14(11-13)21-10-3-7-16(20)22-12-15(19)18-9-4-8-17/h2,5-6,11H,3-4,7,9-10,12H2,1H3,(H,18,19)