methyl 5,6,7,8,9,9a-hexahydro-1H-benzo[7]annulene-2-carboxylate

Systemtic Name: methyl 5,6,7,8,9,9a-hexahydro-1H-benzo[7]annulene-2-carboxylate Openeye Name: methyl 5,6,7,8,9,9a-hexahydro-1H-benzo[7]annulene-2-carboxylate CAS Name: 5,6,7,8,9,9a-hexahydro-1H-benzo[7]annulene-2-carboxylic acid methyl ester IUPAC Name: methyl 5,6,7,8,9,9a-hexahydro-1H-benzo[7]annulene-2-carboxylate Traditional Name: 5,6,7,8,9,9a-hexahydro-1H-benzocycloheptene-2-carboxylic acid methyl ester Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C2CCCCCC2C1

Isomeric SMILES

COC(=O)C1=CC=C2CCCCCC2C1

InChI

InChI=1S/C13H18O2/c1-15-13(14)12-8-7-10-5-3-2-4-6-11(10)9-12/h7-8,11H,2-6,9H2,1H3