2-[(3S,5R)-1-[(cyclobutylmethylamino)methyl]-3,5-dimethyl-cyclohexyl]ethanoic acid

Systemtic Name: 2-[(3S,5R)-1-[(cyclobutylmethylamino)methyl]-3,5-dimethyl-cyclohexyl]ethanoic acid Openeye Name: 2-[(3S,5R)-1-[(cyclobutylmethylamino)methyl]-3,5-dimethyl-cyclohexyl]acetic acid CAS Name: 2-[(3S,5R)-1-[(cyclobutylmethylamino)methyl]-3,5-dimethylcyclohexyl]acetic acid IUPAC Name: 2-[(3S,5R)-1-[(cyclobutylmethylamino)methyl]-3,5-dimethylcyclohexyl]acetic acid Traditional Name: 2-[(3S,5R)-1-[(cyclobutylmethylamino)methyl]-3,5-dimethyl-cyclohexyl]acetic acid Formula: C16H29NO2 MolecularWeight: 267.40696

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(CC(=O)O)CNCC2CCC2)C

Isomeric SMILES

C[C@@H]1C[C@@H](CC(C1)(CC(=O)O)CNCC2CCC2)C

InChI

InChI=1S/C16H29NO2/c1-12-6-13(2)8-16(7-12,9-15(18)19)11-17-10-14-4-3-5-14/h12-14,17H,3-11H2,1-2H3,(H,18,19)/t12-,13+,16?