cyanomethyl 3-(aminocarbonylamino)-3-phenyl-propanoate

Systemtic Name: cyanomethyl 3-(aminocarbonylamino)-3-phenyl-propanoate Openeye Name: cyanomethyl 3-phenyl-3-ureido-propanoate CAS Name: 3-(carbamoylamino)-3-phenylpropanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-(carbamoylamino)-3-phenylpropanoate Traditional Name: 3-phenyl-3-ureido-propionic acid cyanomethyl ester Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)OCC#N)NC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)OCC#N)NC(=O)N

InChI

InChI=1S/C12H13N3O3/c13-6-7-18-11(16)8-10(15-12(14)17)9-4-2-1-3-5-9/h1-5,10H,7-8H2,(H3,14,15,17)