7-(dioxidanylmethyl)-2-methyl-4a-(phenylmethyl)-1,3,4,9,10,10a-hexahydrophenanthren-2-ol

Systemtic Name: 7-(dioxidanylmethyl)-2-methyl-4a-(phenylmethyl)-1,3,4,9,10,10a-hexahydrophenanthren-2-ol Openeye Name: 4a-benzyl-7-(hydroperoxymethyl)-2-methyl-1,3,4,9,10,10a-hexahydrophenanthren-2-ol CAS Name: 7-(hydroperoxymethyl)-2-methyl-4a-(phenylmethyl)-1,3,4,9,10,10a-hexahydrophenanthren-2-ol IUPAC Name: 4a-benzyl-7-(hydroperoxymethyl)-2-methyl-1,3,4,9,10,10a-hexahydrophenanthren-2-ol Traditional Name: 4a-benzyl-7-(hydroperoxymethyl)-2-methyl-1,3,4,9,10,10a-hexahydrophenanthren-2-ol Formula: C23H28O3 MolecularWeight: 352.46662

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2(C(C1)CCC3=C2C=CC(=C3)COO)CC4=CC=CC=C4)O

Isomeric SMILES

CC1(CCC2(C(C1)CCC3=C2C=CC(=C3)COO)CC4=CC=CC=C4)O

InChI

InChI=1S/C23H28O3/c1-22(24)11-12-23(14-17-5-3-2-4-6-17)20(15-22)9-8-19-13-18(16-26-25)7-10-21(19)23/h2-7,10,13,20,24-25H,8-9,11-12,14-16H2,1H3