10-oxidanyl-9-(3-oxidanylidenebutyl)-3-(5-phenylpentan-2-yloxy)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one

Systemtic Name: 10-oxidanyl-9-(3-oxidanylidenebutyl)-3-(5-phenylpentan-2-yloxy)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one Openeye Name: 10-hydroxy-3-(1-methyl-4-phenyl-butoxy)-9-(3-oxobutyl)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one CAS Name: 10-hydroxy-9-(3-oxobutyl)-3-(5-phenylpentan-2-yloxy)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one IUPAC Name: 10-hydroxy-9-(3-oxobutyl)-3-(5-phenylpentan-2-yloxy)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one Traditional Name: 10-hydroxy-9-(3-ketobutyl)-3-(1-methyl-4-phenyl-butoxy)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one Formula: C29H36O4 MolecularWeight: 448.59374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC=CC=C1)OC2=CC(=O)C3=C(C(=C4CCCCC4C3C2)CCC(=O)C)O

Isomeric SMILES

CC(CCCC1=CC=CC=C1)OC2=CC(=O)C3=C(C(=C4CCCCC4C3C2)CCC(=O)C)O

InChI

InChI=1S/C29H36O4/c1-19(30)15-16-25-23-13-6-7-14-24(23)26-17-22(18-27(31)28(26)29(25)32)33-20(2)9-8-12-21-10-4-3-5-11-21/h3-5,10-11,18,20,24,26,32H,6-9,12-17H2,1-2H3