methyl 2-[[(S)-cyano(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]amino]ethanoate

Systemtic Name: methyl 2-[[(S)-cyano(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]amino]ethanoate Openeye Name: methyl 2-[[(S)-cyano(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]amino]acetate CAS Name: 2-[[(S)-cyano(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(S)-cyano(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]amino]acetate Traditional Name: 2-[[(S)-cyano(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]amino]acetic acid methyl ester Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(C#N)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

COC(=O)CN[C@H](C#N)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C13H14N2O4/c1-17-13(16)8-15-10(7-14)9-2-3-11-12(6-9)19-5-4-18-11/h2-3,6,10,15H,4-5,8H2,1H3/t10-/m1/s1