[2-oxidanylidene-2-(pentylamino)ethyl] 2-(2-cyanophenyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(pentylamino)ethyl] 2-(2-cyanophenyl)benzoate Openeye Name: [2-oxo-2-(pentylamino)ethyl] 2-(2-cyanophenyl)benzoate CAS Name: 2-(2-cyanophenyl)benzoic acid [2-oxo-2-(pentylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentylamino)ethyl] 2-(2-cyanophenyl)benzoate Traditional Name: 2-(2-cyanophenyl)benzoic acid [2-(amylamino)-2-keto-ethyl] ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)COC(=O)C1=CC=CC=C1C2=CC=CC=C2C#N

Isomeric SMILES

CCCCCNC(=O)COC(=O)C1=CC=CC=C1C2=CC=CC=C2C#N

InChI

InChI=1S/C21H22N2O3/c1-2-3-8-13-23-20(24)15-26-21(25)19-12-7-6-11-18(19)17-10-5-4-9-16(17)14-22/h4-7,9-12H,2-3,8,13,15H2,1H3,(H,23,24)