methyl (4aS,10aR)-6-methoxy-1,1-dimethyl-3-oxidanylidene-7-propan-2-yl-4,9,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylate

Systemtic Name: methyl (4aS,10aR)-6-methoxy-1,1-dimethyl-3-oxidanylidene-7-propan-2-yl-4,9,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylate Openeye Name: methyl (4aS,10aR)-7-isopropyl-6-methoxy-1,1-dimethyl-3-oxo-4,9,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylate CAS Name: (4aS,10aR)-6-methoxy-1,1-dimethyl-3-oxo-7-propan-2-yl-4,9,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylic acid methyl ester IUPAC Name: methyl (4aS,10aR)-6-methoxy-1,1-dimethyl-3-oxo-7-propan-2-yl-4,9,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylate Traditional Name: (4aS,10aR)-7-isopropyl-3-keto-6-methoxy-1,1-dimethyl-4,9,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylic acid methyl ester Formula: C22H30O4 MolecularWeight: 358.4712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C2C(=C1)CCC3C2(CC(=O)CC3(C)C)C(=O)OC)OC

Isomeric SMILES

CC(C)C1=C(C=C2C(=C1)CC[C@H]3[C@]2(CC(=O)CC3(C)C)C(=O)OC)OC

InChI

InChI=1S/C22H30O4/c1-13(2)16-9-14-7-8-19-21(3,4)11-15(23)12-22(19,20(24)26-6)17(14)10-18(16)25-5/h9-10,13,19H,7-8,11-12H2,1-6H3/t19-,22-/m1/s1