(1Z,4aR,10aR)-8-methoxy-1-[methoxy(oxidanyl)methylidene]-4a-methyl-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthren-2-one

Systemtic Name: (1Z,4aR,10aR)-8-methoxy-1-[methoxy(oxidanyl)methylidene]-4a-methyl-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthren-2-one Openeye Name: (1Z,4aR,10aR)-1-[hydroxy(methoxy)methylene]-7-isopropyl-8-methoxy-4a-methyl-4,9,10,10a-tetrahydro-3H-phenanthren-2-one CAS Name: (1Z,4aR,10aR)-1-[hydroxy(methoxy)methylidene]-8-methoxy-4a-methyl-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthren-2-one IUPAC Name: (1Z,4aR,10aR)-1-[hydroxy(methoxy)methylidene]-8-methoxy-4a-methyl-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthren-2-one Traditional Name: (1Z,4aR,10aR)-1-[hydroxy(methoxy)methylene]-7-isopropyl-8-methoxy-4a-methyl-4,9,10,10a-tetrahydro-3H-phenanthren-2-one Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C2=C(C=C1)C3(CCC(=O)C(=C(O)OC)C3CC2)C)OC

Isomeric SMILES

CC(C)C1=C(C2=C(C=C1)[C@@]3(CCC(=O)/C(=C(/O)\OC)/[C@@H]3CC2)C)OC

InChI

InChI=1S/C21H28O4/c1-12(2)13-6-8-15-14(19(13)24-4)7-9-16-18(20(23)25-5)17(22)10-11-21(15,16)3/h6,8,12,16,23H,7,9-11H2,1-5H3/b20-18-/t16-,21-/m0/s1