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

Systemtic Name: methyl (1S,3S,4S,5R)-3-dodecyl-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: methyl (1S,3S,4S,5R)-3-dodecyl-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: (1S,3S,4S,5R)-3-dodecyl-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester IUPAC Name: methyl (1S,3S,4S,5R)-3-dodecyl-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: (1S,3S,4S,5R)-3-lauryl-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester Formula: C22H41NO2 MolecularWeight: 351.56644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1CC2CCC(C1C(=O)OC)N2C

Isomeric SMILES

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

InChI

InChI=1S/C22H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-18-17-19-15-16-20(23(19)2)21(18)22(24)25-3/h18-21H,4-17H2,1-3H3/t18-,19-,20+,21-/m0/s1