[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 3-(4-cyanophenyl)propanoate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 3-(4-cyanophenyl)propanoate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 3-(4-cyanophenyl)propanoate CAS Name: 3-(4-cyanophenyl)propanoic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 3-(4-cyanophenyl)propanoate Traditional Name: 3-(4-cyanophenyl)propionic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)COC(=O)CCC1=CC=C(C=C1)C#N

Isomeric SMILES

CC(C)CCNC(=O)COC(=O)CCC1=CC=C(C=C1)C#N

InChI

InChI=1S/C17H22N2O3/c1-13(2)9-10-19-16(20)12-22-17(21)8-7-14-3-5-15(11-18)6-4-14/h3-6,13H,7-10,12H2,1-2H3,(H,19,20)