methyl (1S,7R,8aS)-1-methyl-3-oxidanylidene-7-prop-1-en-2-yl-2,5,6,7,8,8a-hexahydro-1H-azulene-4-carboxylate

Systemtic Name: methyl (1S,7R,8aS)-1-methyl-3-oxidanylidene-7-prop-1-en-2-yl-2,5,6,7,8,8a-hexahydro-1H-azulene-4-carboxylate Openeye Name: methyl (1S,7R,8aS)-7-isopropenyl-1-methyl-3-oxo-2,5,6,7,8,8a-hexahydro-1H-azulene-4-carboxylate CAS Name: (1S,7R,8aS)-1-methyl-7-(1-methylethenyl)-3-oxo-2,5,6,7,8,8a-hexahydro-1H-azulene-4-carboxylic acid methyl ester IUPAC Name: methyl (1S,7R,8aS)-1-methyl-3-oxo-7-prop-1-en-2-yl-2,5,6,7,8,8a-hexahydro-1H-azulene-4-carboxylate Traditional Name: (1S,7R,8aS)-7-isopropenyl-3-keto-1-methyl-2,5,6,7,8,8a-hexahydro-1H-azulene-4-carboxylic acid methyl ester Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(CCC(CC12)C(=C)C)C(=O)OC

Isomeric SMILES

C[C@H]1CC(=O)C2=C(CC[C@H](C[C@@H]12)C(=C)C)C(=O)OC

InChI

InChI=1S/C16H22O3/c1-9(2)11-5-6-12(16(18)19-4)15-13(8-11)10(3)7-14(15)17/h10-11,13H,1,5-8H2,2-4H3/t10-,11+,13-/m0/s1