methyl 2-[[(S)-cyano-(4-propoxyphenyl)methyl]amino]ethanoate

Systemtic Name: methyl 2-[[(S)-cyano-(4-propoxyphenyl)methyl]amino]ethanoate Openeye Name: methyl 2-[[(S)-cyano-(4-propoxyphenyl)methyl]amino]acetate CAS Name: 2-[[(S)-cyano-(4-propoxyphenyl)methyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(S)-cyano-(4-propoxyphenyl)methyl]amino]acetate Traditional Name: 2-[[(S)-cyano-(4-propoxyphenyl)methyl]amino]acetic acid methyl ester Formula: C14H18N2O3 MolecularWeight: 262.30432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C#N)NCC(=O)OC

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@@H](C#N)NCC(=O)OC

InChI

InChI=1S/C14H18N2O3/c1-3-8-19-12-6-4-11(5-7-12)13(9-15)16-10-14(17)18-2/h4-7,13,16H,3,8,10H2,1-2H3/t13-/m1/s1