methyl 7-methyl-7-(3-methylbuta-1,3-dien-2-yl)-5-oxidanylidene-2,6-dihydrooxepine-3-carboxylate

Systemtic Name: methyl 7-methyl-7-(3-methylbuta-1,3-dien-2-yl)-5-oxidanylidene-2,6-dihydrooxepine-3-carboxylate Openeye Name: methyl 7-methyl-7-(2-methyl-1-methylene-allyl)-5-oxo-2,6-dihydrooxepine-3-carboxylate CAS Name: 7-methyl-7-(3-methylbuta-1,3-dien-2-yl)-5-oxo-2,6-dihydrooxepin-3-carboxylic acid methyl ester IUPAC Name: methyl 7-methyl-7-(3-methylbuta-1,3-dien-2-yl)-5-oxo-2,6-dihydrooxepine-3-carboxylate Traditional Name: 5-keto-7-methyl-7-(2-methyl-1-methylene-allyl)-2,6-dihydrooxepin-3-carboxylic acid methyl ester Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=C)C1(CC(=O)C=C(CO1)C(=O)OC)C

Isomeric SMILES

CC(=C)C(=C)C1(CC(=O)C=C(CO1)C(=O)OC)C

InChI

InChI=1S/C14H18O4/c1-9(2)10(3)14(4)7-12(15)6-11(8-18-14)13(16)17-5/h6H,1,3,7-8H2,2,4-5H3