(E)-2-cyano-6-methoxy-hept-2-enoic acid

Systemtic Name: (E)-2-cyano-6-methoxy-hept-2-enoic acid Openeye Name: (E)-2-cyano-6-methoxy-hept-2-enoic acid CAS Name: (E)-2-cyano-6-methoxy-2-heptenoic acid IUPAC Name: (E)-2-cyano-6-methoxyhept-2-enoic acid Traditional Name: (E)-2-cyano-6-methoxy-hept-2-enoic acid Formula: C9H13NO3 MolecularWeight: 183.20442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13NO3/c1-7(13-2)4-3-5-8(6-10)9(11)12/h5,7H,3-4H2,1-2H3,(H,11,12)/b8-5+