[2-oxidanylidene-2-(pentylamino)ethyl] (2S)-2-(4-cyanophenoxy)propanoate

Systemtic Name: [2-oxidanylidene-2-(pentylamino)ethyl] (2S)-2-(4-cyanophenoxy)propanoate Openeye Name: [2-oxo-2-(pentylamino)ethyl] (2S)-2-(4-cyanophenoxy)propanoate CAS Name: (2S)-2-(4-cyanophenoxy)propanoic acid [2-oxo-2-(pentylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentylamino)ethyl] (2S)-2-(4-cyanophenoxy)propanoate Traditional Name: (2S)-2-(4-cyanophenoxy)propionic acid [2-(amylamino)-2-keto-ethyl] ester Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)COC(=O)C(C)OC1=CC=C(C=C1)C#N

Isomeric SMILES

CCCCCNC(=O)COC(=O)[C@H](C)OC1=CC=C(C=C1)C#N

InChI

InChI=1S/C17H22N2O4/c1-3-4-5-10-19-16(20)12-22-17(21)13(2)23-15-8-6-14(11-18)7-9-15/h6-9,13H,3-5,10,12H2,1-2H3,(H,19,20)/t13-/m0/s1