(3R,3aR,4aS,8aR,9aR)-3-[[2-hydroxyethyl(methyl)amino]methyl]-8a-methyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one

Systemtic Name: (3R,3aR,4aS,8aR,9aR)-3-[[2-hydroxyethyl(methyl)amino]methyl]-8a-methyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one Openeye Name: (3R,3aR,4aS,8aR,9aR)-3-[[2-hydroxyethyl(methyl)amino]methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one CAS Name: (3R,3aR,4aS,8aR,9aR)-3-[[2-hydroxyethyl(methyl)amino]methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one IUPAC Name: (3R,3aR,4aS,8aR,9aR)-3-[[2-hydroxyethyl(methyl)amino]methyl]-8a-methyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one Traditional Name: (3R,3aR,4aS,8aR,9aR)-3-[[2-hydroxyethyl(methyl)amino]methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one Formula: C18H29NO3 MolecularWeight: 307.42776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CCCC(=C)C1CC3C(C2)OC(=O)C3CN(C)CCO

Isomeric SMILES

C[C@]12CCCC(=C)[C@@H]1C[C@H]3[C@@H](C2)OC(=O)[C@H]3CN(C)CCO

InChI

InChI=1S/C18H29NO3/c1-12-5-4-6-18(2)10-16-13(9-15(12)18)14(17(21)22-16)11-19(3)7-8-20/h13-16,20H,1,4-11H2,2-3H3/t13-,14+,15+,16-,18-/m1/s1