1-butyl-2-methyl-7-oxidanyl-2,4,4a,9,10,10a-hexahydro-1H-phenanthren-3-one

Systemtic Name: 1-butyl-2-methyl-7-oxidanyl-2,4,4a,9,10,10a-hexahydro-1H-phenanthren-3-one Openeye Name: 1-butyl-7-hydroxy-2-methyl-2,4,4a,9,10,10a-hexahydro-1H-phenanthren-3-one CAS Name: 1-butyl-7-hydroxy-2-methyl-2,4,4a,9,10,10a-hexahydro-1H-phenanthren-3-one IUPAC Name: 1-butyl-7-hydroxy-2-methyl-2,4,4a,9,10,10a-hexahydro-1H-phenanthren-3-one Traditional Name: 1-butyl-7-hydroxy-2-methyl-2,4,4a,9,10,10a-hexahydro-1H-phenanthren-3-one Formula: C19H26O2 MolecularWeight: 286.40854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(C(=O)CC2C1CCC3=C2C=CC(=C3)O)C

Isomeric SMILES

CCCCC1C(C(=O)CC2C1CCC3=C2C=CC(=C3)O)C

InChI

InChI=1S/C19H26O2/c1-3-4-5-15-12(2)19(21)11-18-16-9-7-14(20)10-13(16)6-8-17(15)18/h7,9-10,12,15,17-18,20H,3-6,8,11H2,1-2H3