ethyl 2-[[2-(methylaminomethyl)-1,3-oxazol-4-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[2-(methylaminomethyl)-1,3-oxazol-4-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: ethyl 2-[[2-(methylaminomethyl)oxazole-4-carbonyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[2-(methylaminomethyl)-4-oxazolyl]-oxomethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(methylaminomethyl)-1,3-oxazole-4-carbonyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-(methylaminomethyl)oxazole-4-carbonyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2=COC(=N2)CNC

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2=COC(=N2)CNC

InChI

InChI=1S/C17H21N3O4/c1-3-23-17(22)13(9-12-7-5-4-6-8-12)20-16(21)14-11-24-15(19-14)10-18-2/h4-8,11,13,18H,3,9-10H2,1-2H3,(H,20,21)