[2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-(4-cyanophenyl)propanoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-(4-cyanophenyl)propanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 3-(4-cyanophenyl)propanoate CAS Name: 3-(4-cyanophenyl)propanoic acid [2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxo-1-phenylethyl] 3-(4-cyanophenyl)propanoate Traditional Name: 3-(4-cyanophenyl)propionic acid [2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)CCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)CCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H20N2O3/c22-14-16-8-6-15(7-9-16)10-13-19(24)26-20(17-4-2-1-3-5-17)21(25)23-18-11-12-18/h1-9,18,20H,10-13H2,(H,23,25)