methyl (1R,4aR)-1,4a-dimethyl-6-oxidanylidene-7-propan-2-yl-3,4,4b,5,10,10a-hexahydro-2H-phenanthrene-1-carboxylate

Systemtic Name: methyl (1R,4aR)-1,4a-dimethyl-6-oxidanylidene-7-propan-2-yl-3,4,4b,5,10,10a-hexahydro-2H-phenanthrene-1-carboxylate Openeye Name: methyl (1R,4aR)-7-isopropyl-1,4a-dimethyl-6-oxo-3,4,4b,5,10,10a-hexahydro-2H-phenanthrene-1-carboxylate CAS Name: (1R,4aR)-1,4a-dimethyl-6-oxo-7-propan-2-yl-3,4,4b,5,10,10a-hexahydro-2H-phenanthrene-1-carboxylic acid methyl ester IUPAC Name: methyl (1R,4aR)-1,4a-dimethyl-6-oxo-7-propan-2-yl-3,4,4b,5,10,10a-hexahydro-2H-phenanthrene-1-carboxylate Traditional Name: (1R,4aR)-7-isopropyl-6-keto-1,4a-dimethyl-3,4,4b,5,10,10a-hexahydro-2H-phenanthrene-1-carboxylic acid methyl ester Formula: C21H30O3 MolecularWeight: 330.4611

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=CCC3C(C2CC1=O)(CCCC3(C)C(=O)OC)C

Isomeric SMILES

CC(C)C1=CC2=CCC3[C@@](C2CC1=O)(CCC[C@@]3(C)C(=O)OC)C

InChI

InChI=1S/C21H30O3/c1-13(2)15-11-14-7-8-18-20(3,16(14)12-17(15)22)9-6-10-21(18,4)19(23)24-5/h7,11,13,16,18H,6,8-10,12H2,1-5H3/t16?,18?,20-,21-/m1/s1