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

Systemtic Name: methyl 2-[[(S)-cyano-(4-methylphenyl)methyl]amino]ethanoate Openeye Name: methyl 2-[[(S)-cyano(p-tolyl)methyl]amino]acetate CAS Name: 2-[[(S)-cyano-(4-methylphenyl)methyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(S)-cyano-(4-methylphenyl)methyl]amino]acetate Traditional Name: 2-[[(S)-cyano(p-tolyl)methyl]amino]acetic acid methyl ester Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C#N)NCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C#N)NCC(=O)OC

InChI

InChI=1S/C12H14N2O2/c1-9-3-5-10(6-4-9)11(7-13)14-8-12(15)16-2/h3-6,11,14H,8H2,1-2H3/t11-/m1/s1