ethyl 3-[4-(2-cyanophenyl)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: ethyl 3-[4-(2-cyanophenyl)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: ethyl 2-(tert-butoxycarbonylamino)-3-[4-(2-cyanophenyl)phenyl]propanoate CAS Name: 3-[4-(2-cyanophenyl)phenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(2-cyanophenyl)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-[4-(2-cyanophenyl)phenyl]propionic acid ethyl ester Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2C#N)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2C#N)NC(=O)OC(C)(C)C

InChI

InChI=1S/C23H26N2O4/c1-5-28-21(26)20(25-22(27)29-23(2,3)4)14-16-10-12-17(13-11-16)19-9-7-6-8-18(19)15-24/h6-13,20H,5,14H2,1-4H3,(H,25,27)