ethyl (1R,3aR,5R)-3a-methyl-5-oxidanyl-1-propan-2-yl-2,3,4,5-tetrahydro-1H-azulene-6-carboxylate

Systemtic Name: ethyl (1R,3aR,5R)-3a-methyl-5-oxidanyl-1-propan-2-yl-2,3,4,5-tetrahydro-1H-azulene-6-carboxylate Openeye Name: ethyl (1R,3aR,5R)-5-hydroxy-1-isopropyl-3a-methyl-2,3,4,5-tetrahydro-1H-azulene-6-carboxylate CAS Name: (1R,3aR,5R)-5-hydroxy-3a-methyl-1-propan-2-yl-2,3,4,5-tetrahydro-1H-azulene-6-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,3aR,5R)-5-hydroxy-3a-methyl-1-propan-2-yl-2,3,4,5-tetrahydro-1H-azulene-6-carboxylate Traditional Name: (1R,3aR,5R)-5-hydroxy-1-isopropyl-3a-methyl-2,3,4,5-tetrahydro-1H-azulene-6-carboxylic acid ethyl ester Formula: C17H26O3 MolecularWeight: 278.38654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C2C(CCC2(CC1O)C)C(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C2[C@H](CC[C@@]2(C[C@H]1O)C)C(C)C

InChI

InChI=1S/C17H26O3/c1-5-20-16(19)13-6-7-14-12(11(2)3)8-9-17(14,4)10-15(13)18/h6-7,11-12,15,18H,5,8-10H2,1-4H3/t12-,15-,17-/m1/s1