methyl (E)-2-cyano-2,3-dimethyl-oct-3-enoate

Systemtic Name: methyl (E)-2-cyano-2,3-dimethyl-oct-3-enoate Openeye Name: methyl (E)-2-cyano-2,3-dimethyl-oct-3-enoate CAS Name: (E)-2-cyano-2,3-dimethyl-3-octenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-2,3-dimethyloct-3-enoate Traditional Name: (E)-2-cyano-2,3-dimethyl-oct-3-enoic acid methyl ester Formula: C12H19NO2 MolecularWeight: 209.28476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=C(C)C(C)(C#N)C(=O)OC

Isomeric SMILES

CCCC/C=C(\C)/C(C)(C#N)C(=O)OC

InChI

InChI=1S/C12H19NO2/c1-5-6-7-8-10(2)12(3,9-13)11(14)15-4/h8H,5-7H2,1-4H3/b10-8+