(2S)-2-(3-methoxy-4-prop-2-enoxy-phenyl)-2-oxidanyl-ethanenitrile

Systemtic Name: (2S)-2-(3-methoxy-4-prop-2-enoxy-phenyl)-2-oxidanyl-ethanenitrile Openeye Name: (2S)-2-(4-allyloxy-3-methoxy-phenyl)-2-hydroxy-acetonitrile CAS Name: (2S)-2-hydroxy-2-(3-methoxy-4-prop-2-enoxyphenyl)acetonitrile IUPAC Name: (2S)-2-hydroxy-2-(3-methoxy-4-prop-2-enoxyphenyl)acetonitrile Traditional Name: (2S)-2-(4-allyloxy-3-methoxy-phenyl)-2-hydroxy-acetonitrile Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C#N)O)OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)[C@@H](C#N)O)OCC=C

InChI

InChI=1S/C12H13NO3/c1-3-6-16-11-5-4-9(10(14)8-13)7-12(11)15-2/h3-5,7,10,14H,1,6H2,2H3/t10-/m1/s1