methyl 9-acetyloxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate

Systemtic Name: methyl 9-acetyloxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate Openeye Name: methyl 9-acetoxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate CAS Name: 9-acetyloxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid methyl ester IUPAC Name: methyl 9-acetyloxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate Traditional Name: 9-acetoxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid methyl ester Formula: C20H26O4 MolecularWeight: 330.41804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC2C(CCCC2(C)C(=O)OC)(C3=CC=CC=C13)C

Isomeric SMILES

CC(=O)OC1CC2C(CCCC2(C)C(=O)OC)(C3=CC=CC=C13)C

InChI

InChI=1S/C20H26O4/c1-13(21)24-16-12-17-19(2,15-9-6-5-8-14(15)16)10-7-11-20(17,3)18(22)23-4/h5-6,8-9,16-17H,7,10-12H2,1-4H3