methyl (E)-2-cyano-4,4-dimethyl-pent-2-enoate

Systemtic Name: methyl (E)-2-cyano-4,4-dimethyl-pent-2-enoate Openeye Name: methyl (E)-2-cyano-4,4-dimethyl-pent-2-enoate CAS Name: (E)-2-cyano-4,4-dimethyl-2-pentenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-4,4-dimethylpent-2-enoate Traditional Name: (E)-2-cyano-4,4-dimethyl-pent-2-enoic acid methyl ester Formula: C9H13NO2 MolecularWeight: 167.20502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13NO2/c1-9(2,3)5-7(6-10)8(11)12-4/h5H,1-4H3/b7-5+