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

Systemtic Name: 10-oxidanyl-9-(3-oxidanylidenebutyl)-3-(4-phenylbutoxy)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one Openeye Name: 10-hydroxy-9-(3-oxobutyl)-3-(4-phenylbutoxy)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one CAS Name: 10-hydroxy-9-(3-oxobutyl)-3-(4-phenylbutoxy)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one IUPAC Name: 10-hydroxy-9-(3-oxobutyl)-3-(4-phenylbutoxy)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one Traditional Name: 10-hydroxy-9-(3-ketobutyl)-3-(4-phenylbutoxy)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one Formula: C28H34O4 MolecularWeight: 434.56716

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=C2CCCCC2C3CC(=CC(=O)C3=C1O)OCCCCC4=CC=CC=C4

Isomeric SMILES

CC(=O)CCC1=C2CCCCC2C3CC(=CC(=O)C3=C1O)OCCCCC4=CC=CC=C4

InChI

InChI=1S/C28H34O4/c1-19(29)14-15-24-22-12-5-6-13-23(22)25-17-21(18-26(30)27(25)28(24)31)32-16-8-7-11-20-9-3-2-4-10-20/h2-4,9-10,18,23,25,31H,5-8,11-17H2,1H3