methyl (2S)-2-[2-[2-(4-cyanophenoxy)ethanoyloxy]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[2-[2-(4-cyanophenoxy)ethanoyloxy]ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[2-[2-(4-cyanophenoxy)acetyl]oxyacetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-[2-(4-cyanophenoxy)-1-oxoethoxy]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-[2-(4-cyanophenoxy)acetyl]oxyacetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-[2-(4-cyanophenoxy)acetyl]oxyacetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)COC(=O)COC2=CC=C(C=C2)C#N

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)COC(=O)COC2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H20N2O6/c1-27-21(26)18(11-15-5-3-2-4-6-15)23-19(24)13-29-20(25)14-28-17-9-7-16(12-22)8-10-17/h2-10,18H,11,13-14H2,1H3,(H,23,24)/t18-/m0/s1