3-hexyl-5,5-dimethyl-6,7,8,9-tetrahydrobenzo[7]annulene-2-carboxylic acid

Systemtic Name: 3-hexyl-5,5-dimethyl-6,7,8,9-tetrahydrobenzo[7]annulene-2-carboxylic acid Openeye Name: 3-hexyl-5,5-dimethyl-6,7,8,9-tetrahydrobenzo[7]annulene-2-carboxylic acid CAS Name: 3-hexyl-5,5-dimethyl-6,7,8,9-tetrahydrobenzo[7]annulene-2-carboxylic acid IUPAC Name: 3-hexyl-5,5-dimethyl-6,7,8,9-tetrahydrobenzo[7]annulene-2-carboxylic acid Traditional Name: 3-hexyl-5,5-dimethyl-6,7,8,9-tetrahydrobenzocycloheptene-2-carboxylic acid Formula: C20H30O2 MolecularWeight: 302.451

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(CCCCC2(C)C)C=C1C(=O)O

Isomeric SMILES

CCCCCCC1=CC2=C(CCCCC2(C)C)C=C1C(=O)O

InChI

InChI=1S/C20H30O2/c1-4-5-6-7-10-15-14-18-16(13-17(15)19(21)22)11-8-9-12-20(18,2)3/h13-14H,4-12H2,1-3H3,(H,21,22)