[2-oxidanylidene-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl] (2S)-2-(4-cyanophenoxy)propanoate

Systemtic Name: [2-oxidanylidene-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl] (2S)-2-(4-cyanophenoxy)propanoate Openeye Name: [2-oxo-2-[[(1S)-1-(2-thienyl)ethyl]amino]ethyl] (2S)-2-(4-cyanophenoxy)propanoate CAS Name: (2S)-2-(4-cyanophenoxy)propanoic acid [2-oxo-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl] (2S)-2-(4-cyanophenoxy)propanoate Traditional Name: (2S)-2-(4-cyanophenoxy)propionic acid [2-keto-2-[[(1S)-1-(2-thienyl)ethyl]amino]ethyl] ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)COC(=O)C(C)OC2=CC=C(C=C2)C#N

Isomeric SMILES

C[C@@H](C1=CC=CS1)NC(=O)COC(=O)[C@H](C)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H18N2O4S/c1-12(16-4-3-9-25-16)20-17(21)11-23-18(22)13(2)24-15-7-5-14(10-19)6-8-15/h3-9,12-13H,11H2,1-2H3,(H,20,21)/t12-,13-/m0/s1