methyl (E)-6-methyl-4-oxidanylidene-hept-2-enoate

Systemtic Name: methyl (E)-6-methyl-4-oxidanylidene-hept-2-enoate Openeye Name: methyl (E)-6-methyl-4-oxo-hept-2-enoate CAS Name: (E)-6-methyl-4-oxo-2-heptenoic acid methyl ester IUPAC Name: methyl (E)-6-methyl-4-oxohept-2-enoate Traditional Name: (E)-4-keto-6-methyl-hept-2-enoic acid methyl ester Formula: C9H14O3 MolecularWeight: 170.20566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C=CC(=O)OC

Isomeric SMILES

CC(C)CC(=O)/C=C/C(=O)OC

InChI

InChI=1S/C9H14O3/c1-7(2)6-8(10)4-5-9(11)12-3/h4-5,7H,6H2,1-3H3/b5-4+