triethyl (3aR,6S,8aS)-8a-methyl-4-methylidene-3,3a,5,6-tetrahydro-1H-azulene-2,2,6-tricarboxylate

Systemtic Name: triethyl (3aR,6S,8aS)-8a-methyl-4-methylidene-3,3a,5,6-tetrahydro-1H-azulene-2,2,6-tricarboxylate Openeye Name: triethyl (3aR,6S,8aS)-8a-methyl-4-methylene-3,3a,5,6-tetrahydro-1H-azulene-2,2,6-tricarboxylate CAS Name: (3aR,6S,8aS)-8a-methyl-4-methylene-3,3a,5,6-tetrahydro-1H-azulene-2,2,6-tricarboxylic acid triethyl ester IUPAC Name: triethyl (3aR,6S,8aS)-8a-methyl-4-methylidene-3,3a,5,6-tetrahydro-1H-azulene-2,2,6-tricarboxylate Traditional Name: (3aR,6S,8aS)-8a-methyl-4-methylene-3,3a,5,6-tetrahydro-1H-azulene-2,2,6-tricarboxylic acid triethyl ester Formula: C21H30O6 MolecularWeight: 378.4593

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(=C)C2CC(CC2(C=C1)C)(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)[C@H]1CC(=C)[C@H]2CC(C[C@]2(C=C1)C)(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C21H30O6/c1-6-25-17(22)15-9-10-20(5)13-21(18(23)26-7-2,19(24)27-8-3)12-16(20)14(4)11-15/h9-10,15-16H,4,6-8,11-13H2,1-3,5H3/t15-,16-,20-/m1/s1