1-(3-methylbutyl)-7-oxidanyl-2,4,4a,9,10,10a-hexahydro-1H-phenanthren-3-one

Systemtic Name: 1-(3-methylbutyl)-7-oxidanyl-2,4,4a,9,10,10a-hexahydro-1H-phenanthren-3-one Openeye Name: 7-hydroxy-1-isopentyl-2,4,4a,9,10,10a-hexahydro-1H-phenanthren-3-one CAS Name: 7-hydroxy-1-(3-methylbutyl)-2,4,4a,9,10,10a-hexahydro-1H-phenanthren-3-one IUPAC Name: 7-hydroxy-1-(3-methylbutyl)-2,4,4a,9,10,10a-hexahydro-1H-phenanthren-3-one Traditional Name: 7-hydroxy-1-isoamyl-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:

CC(C)CCC1CC(=O)CC2C1CCC3=C2C=CC(=C3)O

Isomeric SMILES

CC(C)CCC1CC(=O)CC2C1CCC3=C2C=CC(=C3)O

InChI

InChI=1S/C19H26O2/c1-12(2)3-4-13-10-16(21)11-19-17(13)7-5-14-9-15(20)6-8-18(14)19/h6,8-9,12-13,17,19-20H,3-5,7,10-11H2,1-2H3