(1S,2S)-1-(diethylaminomethyl)-2-(methoxymethyl)-3-methyl-4-oxidanylidene-cyclohexane-1-carboxylic acid

Systemtic Name: (1S,2S)-1-(diethylaminomethyl)-2-(methoxymethyl)-3-methyl-4-oxidanylidene-cyclohexane-1-carboxylic acid Openeye Name: (1S,2S)-1-(diethylaminomethyl)-2-(methoxymethyl)-3-methyl-4-oxo-cyclohexanecarboxylic acid CAS Name: (1S,2S)-1-(diethylaminomethyl)-2-(methoxymethyl)-3-methyl-4-oxo-1-cyclohexanecarboxylic acid IUPAC Name: (1S,2S)-1-(diethylaminomethyl)-2-(methoxymethyl)-3-methyl-4-oxocyclohexane-1-carboxylic acid Traditional Name: (1S,2S)-1-(diethylaminomethyl)-4-keto-2-(methoxymethyl)-3-methyl-cyclohexanecarboxylic acid Formula: C15H27NO4 MolecularWeight: 285.37918

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1(CCC(=O)C(C1COC)C)C(=O)O

Isomeric SMILES

CCN(CC)C[C@@]1(CCC(=O)C([C@@H]1COC)C)C(=O)O

InChI

InChI=1S/C15H27NO4/c1-5-16(6-2)10-15(14(18)19)8-7-13(17)11(3)12(15)9-20-4/h11-12H,5-10H2,1-4H3,(H,18,19)/t11?,12-,15+/m0/s1