ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-pyrimidin-5-ylphenyl)propanoate

Systemtic Name: ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-pyrimidin-5-ylphenyl)propanoate Openeye Name: ethyl 2-(tert-butoxycarbonylamino)-3-(4-pyrimidin-5-ylphenyl)propanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[4-(5-pyrimidinyl)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-pyrimidin-5-ylphenyl)propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-[4-(5-pyrimidyl)phenyl]propionic acid ethyl ester Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)C2=CN=CN=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)C2=CN=CN=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H25N3O4/c1-5-26-18(24)17(23-19(25)27-20(2,3)4)10-14-6-8-15(9-7-14)16-11-21-13-22-12-16/h6-9,11-13,17H,5,10H2,1-4H3,(H,23,25)