methyl (1R,4aR)-6-methoxy-1,4a-dimethyl-9-oxidanyl-7-propan-2-yl-2,3,4,9-tetrahydrophenanthrene-1-carboxylate

Systemtic Name: methyl (1R,4aR)-6-methoxy-1,4a-dimethyl-9-oxidanyl-7-propan-2-yl-2,3,4,9-tetrahydrophenanthrene-1-carboxylate Openeye Name: methyl (1R,4aR)-9-hydroxy-7-isopropyl-6-methoxy-1,4a-dimethyl-2,3,4,9-tetrahydrophenanthrene-1-carboxylate CAS Name: (1R,4aR)-9-hydroxy-6-methoxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9-tetrahydrophenanthrene-1-carboxylic acid methyl ester IUPAC Name: methyl (1R,4aR)-9-hydroxy-6-methoxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9-tetrahydrophenanthrene-1-carboxylate Traditional Name: (1R,4aR)-9-hydroxy-7-isopropyl-6-methoxy-1,4a-dimethyl-2,3,4,9-tetrahydrophenanthrene-1-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)C(C=C3C2(CCCC3(C)C(=O)OC)C)O)OC

Isomeric SMILES

CC(C)C1=C(C=C2C(=C1)C(C=C3[C@@]2(CCC[C@@]3(C)C(=O)OC)C)O)OC

InChI

InChI=1S/C22H30O4/c1-13(2)14-10-15-16(11-18(14)25-5)21(3)8-7-9-22(4,20(24)26-6)19(21)12-17(15)23/h10-13,17,23H,7-9H2,1-6H3/t17?,21-,22-/m1/s1