methyl (4aS,10aS)-5,6-dimethoxy-1,1,10a-trimethyl-3-oxidanylidene-7-propan-2-yl-4,4a-dihydro-2H-phenanthrene-4-carboxylate

Systemtic Name: methyl (4aS,10aS)-5,6-dimethoxy-1,1,10a-trimethyl-3-oxidanylidene-7-propan-2-yl-4,4a-dihydro-2H-phenanthrene-4-carboxylate Openeye Name: methyl (4aS,10aS)-7-isopropyl-5,6-dimethoxy-1,1,10a-trimethyl-3-oxo-4,4a-dihydro-2H-phenanthrene-4-carboxylate CAS Name: (4aS,10aS)-5,6-dimethoxy-1,1,10a-trimethyl-3-oxo-7-propan-2-yl-4,4a-dihydro-2H-phenanthrene-4-carboxylic acid methyl ester IUPAC Name: methyl (4aS,10aS)-5,6-dimethoxy-1,1,10a-trimethyl-3-oxo-7-propan-2-yl-4,4a-dihydro-2H-phenanthrene-4-carboxylate Traditional Name: (4aS,10aS)-7-isopropyl-3-keto-5,6-dimethoxy-1,1,10a-trimethyl-4,4a-dihydro-2H-phenanthrene-4-carboxylic acid methyl ester Formula: C24H32O5 MolecularWeight: 400.50788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C2C3C(C(=O)CC(C3(C=CC2=C1)C)(C)C)C(=O)OC)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C24H32O5/c1-13(2)15-11-14-9-10-24(5)19(17(14)21(28-7)20(15)27-6)18(22(26)29-8)16(25)12-23(24,3)4/h9-11,13,18-19H,12H2,1-8H3/t18?,19-,24-/m0/s1