(4aS,8aS)-8a-butyl-4a-oxidanyl-2,3,4,5,7,8-hexahydronaphthalene-1,6-dione

Systemtic Name: (4aS,8aS)-8a-butyl-4a-oxidanyl-2,3,4,5,7,8-hexahydronaphthalene-1,6-dione Openeye Name: (4aS,8aS)-8a-butyl-4a-hydroxy-decalin-1,6-dione CAS Name: (4aS,8aS)-8a-butyl-4a-hydroxy-2,3,4,5,7,8-hexahydronaphthalene-1,6-dione IUPAC Name: (4aS,8aS)-8a-butyl-4a-hydroxy-2,3,4,5,7,8-hexahydronaphthalene-1,6-dione Traditional Name: (4aS,8aS)-8a-butyl-4a-hydroxy-decalin-1,6-quinone Formula: C14H22O3 MolecularWeight: 238.32268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC12CCC(=O)CC1(CCCC2=O)O

Isomeric SMILES

CCCC[C@]12CCC(=O)C[C@]1(CCCC2=O)O

InChI

InChI=1S/C14H22O3/c1-2-3-7-13-9-6-11(15)10-14(13,17)8-4-5-12(13)16/h17H,2-10H2,1H3/t13-,14+/m1/s1