dimethyl (4bS,8S)-4b,8-dimethyl-8-morpholin-4-ylcarbonyl-5,6,7,8a-tetrahydrophenanthrene-2,3-dicarboxylate

Systemtic Name: dimethyl (4bS,8S)-4b,8-dimethyl-8-morpholin-4-ylcarbonyl-5,6,7,8a-tetrahydrophenanthrene-2,3-dicarboxylate Openeye Name: dimethyl (4bS,8S)-4b,8-dimethyl-8-(morpholine-4-carbonyl)-5,6,7,8a-tetrahydrophenanthrene-2,3-dicarboxylate CAS Name: (4bS,8S)-4b,8-dimethyl-8-[4-morpholinyl(oxo)methyl]-5,6,7,8a-tetrahydrophenanthrene-2,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4bS,8S)-4b,8-dimethyl-8-(morpholine-4-carbonyl)-5,6,7,8a-tetrahydrophenanthrene-2,3-dicarboxylate Traditional Name: (4bS,8S)-4b,8-dimethyl-8-(morpholine-4-carbonyl)-5,6,7,8a-tetrahydrophenanthrene-2,3-dicarboxylic acid dimethyl ester Formula: C25H31NO6 MolecularWeight: 441.51674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CCCC(C1C=CC3=CC(=C(C=C23)C(=O)OC)C(=O)OC)(C)C(=O)N4CCOCC4

Isomeric SMILES

C[C@]12CCC[C@](C1C=CC3=CC(=C(C=C23)C(=O)OC)C(=O)OC)(C)C(=O)N4CCOCC4

InChI

InChI=1S/C25H31NO6/c1-24-8-5-9-25(2,23(29)26-10-12-32-13-11-26)20(24)7-6-16-14-17(21(27)30-3)18(15-19(16)24)22(28)31-4/h6-7,14-15,20H,5,8-13H2,1-4H3/t20?,24-,25+/m1/s1