ethyl 3-azanyl-3-phenyl-propanoate; 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: ethyl 3-azanyl-3-phenyl-propanoate; 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-phenyl-propanoic acid; ethyl 3-amino-3-phenyl-propanoate CAS Name: 3-amino-3-phenylpropanoic acid ethyl ester; 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: ethyl 3-amino-3-phenylpropanoate; 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 3-amino-3-phenyl-propionic acid ethyl ester; 2-(benzyloxycarbonylamino)-3-phenyl-propionic acid Formula: C28H32N2O6 MolecularWeight: 492.56348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CC=C1)N.C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC(C1=CC=CC=C1)N.C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H17NO4.C11H15NO2/c19-16(20)15(11-13-7-3-1-4-8-13)18-17(21)22-12-14-9-5-2-6-10-14;1-2-14-11(13)8-10(12)9-6-4-3-5-7-9/h1-10,15H,11-12H2,(H,18,21)(H,19,20);3-7,10H,2,8,12H2,1H3