methyl 7-ethenyl-1,1,7-trimethyl-4b-oxidanyl-9-oxidanylidene-3,4,5,6,10,10a-hexahydro-2H-phenanthrene-4a-carboxylate

Systemtic Name: methyl 7-ethenyl-1,1,7-trimethyl-4b-oxidanyl-9-oxidanylidene-3,4,5,6,10,10a-hexahydro-2H-phenanthrene-4a-carboxylate Openeye Name: methyl 4b-hydroxy-1,1,7-trimethyl-9-oxo-7-vinyl-3,4,5,6,10,10a-hexahydro-2H-phenanthrene-4a-carboxylate CAS Name: 7-ethenyl-4b-hydroxy-1,1,7-trimethyl-9-oxo-3,4,5,6,10,10a-hexahydro-2H-phenanthrene-4a-carboxylic acid methyl ester IUPAC Name: methyl 7-ethenyl-4b-hydroxy-1,1,7-trimethyl-9-oxo-3,4,5,6,10,10a-hexahydro-2H-phenanthrene-4a-carboxylate Traditional Name: 4b-hydroxy-9-keto-1,1,7-trimethyl-7-vinyl-3,4,5,6,10,10a-hexahydro-2H-phenanthrene-4a-carboxylic acid methyl ester Formula: C21H30O4 MolecularWeight: 346.4605

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC2(C1CC(=O)C3=CC(CCC32O)(C)C=C)C(=O)OC)C

Isomeric SMILES

CC1(CCCC2(C1CC(=O)C3=CC(CCC32O)(C)C=C)C(=O)OC)C

InChI

InChI=1S/C21H30O4/c1-6-19(4)10-11-21(24)14(13-19)15(22)12-16-18(2,3)8-7-9-20(16,21)17(23)25-5/h6,13,16,24H,1,7-12H2,2-5H3