methyl (1S,3R,4S,5R)-3-heptan-2-yl-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate

Systemtic Name: methyl (1S,3R,4S,5R)-3-heptan-2-yl-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: methyl (1S,3R,4S,5R)-8-methyl-3-(1-methylhexyl)-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: (1S,3R,4S,5R)-3-heptan-2-yl-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester IUPAC Name: methyl (1S,3R,4S,5R)-3-heptan-2-yl-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: (1S,3R,4S,5R)-8-methyl-3-(1-methylhexyl)-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester Formula: C17H31NO2 MolecularWeight: 281.43354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1CC2CCC(C1C(=O)OC)N2C

Isomeric SMILES

CCCCCC(C)[C@H]1C[C@@H]2CC[C@H]([C@H]1C(=O)OC)N2C

InChI

InChI=1S/C17H31NO2/c1-5-6-7-8-12(2)14-11-13-9-10-15(18(13)3)16(14)17(19)20-4/h12-16H,5-11H2,1-4H3/t12?,13-,14+,15+,16-/m0/s1