[(1R)-1-cyanoethyl] (3R)-3-(aminocarbonylamino)-3-(3-phenoxyphenyl)propanoate

Systemtic Name: [(1R)-1-cyanoethyl] (3R)-3-(aminocarbonylamino)-3-(3-phenoxyphenyl)propanoate Openeye Name: [(1R)-1-cyanoethyl] (3R)-3-(3-phenoxyphenyl)-3-ureido-propanoate CAS Name: (3R)-3-(carbamoylamino)-3-(3-phenoxyphenyl)propanoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] (3R)-3-(carbamoylamino)-3-(3-phenoxyphenyl)propanoate Traditional Name: (3R)-3-(3-phenoxyphenyl)-3-ureido-propionic acid [(1R)-1-cyanoethyl] ester Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O4/c1-13(12-20)25-18(23)11-17(22-19(21)24)14-6-5-9-16(10-14)26-15-7-3-2-4-8-15/h2-10,13,17H,11H2,1H3,(H3,21,22,24)/t13-,17-/m1/s1