methyl (1S,2R,4aS,8aR)-3-methyl-2-[(2R)-2-oxidanylbutyl]-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylate

Systemtic Name: methyl (1S,2R,4aS,8aR)-3-methyl-2-[(2R)-2-oxidanylbutyl]-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylate Openeye Name: methyl (1S,2R,4aS,8aR)-2-[(2R)-2-hydroxybutyl]-3-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylate CAS Name: (1S,2R,4aS,8aR)-2-[(2R)-2-hydroxybutyl]-3-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylic acid methyl ester IUPAC Name: methyl (1S,2R,4aS,8aR)-2-[(2R)-2-hydroxybutyl]-3-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylate Traditional Name: (1S,2R,4aS,8aR)-2-[(2R)-2-hydroxybutyl]-3-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylic acid methyl ester Formula: C17H28O3 MolecularWeight: 280.40242

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1C(C2CCCCC2C=C1C)C(=O)OC)O

Isomeric SMILES

CC[C@H](C[C@@H]1[C@H]([C@@H]2CCCC[C@@H]2C=C1C)C(=O)OC)O

InChI

InChI=1S/C17H28O3/c1-4-13(18)10-15-11(2)9-12-7-5-6-8-14(12)16(15)17(19)20-3/h9,12-16,18H,4-8,10H2,1-3H3/t12-,13-,14-,15+,16+/m1/s1