[(3R)-4-azanylidene-3-cyano-2-oxidanylidene-pentyl] 4-oxidanylidene-4-(4-propoxyphenyl)butanoate

Systemtic Name: [(3R)-4-azanylidene-3-cyano-2-oxidanylidene-pentyl] 4-oxidanylidene-4-(4-propoxyphenyl)butanoate Openeye Name: [(3R)-3-cyano-4-imino-2-oxo-pentyl] 4-oxo-4-(4-propoxyphenyl)butanoate CAS Name: 4-oxo-4-(4-propoxyphenyl)butanoic acid [(3R)-3-cyano-4-imino-2-oxopentyl] ester IUPAC Name: [(3R)-3-cyano-4-imino-2-oxopentyl] 4-oxo-4-(4-propoxyphenyl)butanoate Traditional Name: 4-keto-4-(4-propoxyphenyl)butyric acid [(3R)-3-cyano-4-imino-2-keto-pentyl] ester Formula: C19H22N2O5 MolecularWeight: 358.38838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)OCC(=O)C(C#N)C(=N)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)OCC(=O)[C@@H](C#N)C(=N)C

InChI

InChI=1S/C19H22N2O5/c1-3-10-25-15-6-4-14(5-7-15)17(22)8-9-19(24)26-12-18(23)16(11-20)13(2)21/h4-7,16,21H,3,8-10,12H2,1-2H3/t16-/m0/s1