(1R,2R)-2-[methyl-[(1-methylpyrazol-3-yl)methyl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2R)-2-[methyl-[(1-methylpyrazol-3-yl)methyl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2R)-2-[methyl-[(1-methylpyrazol-3-yl)methyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2R)-2-[[methyl-[(1-methyl-3-pyrazolyl)methyl]amino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2R)-2-[methyl-[(1-methylpyrazol-3-yl)methyl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2R)-2-[methyl-[(1-methylpyrazol-3-yl)methyl]carbamoyl]cyclohexanecarboxylic acid Formula: C14H21N3O3 MolecularWeight: 279.33484

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)CN(C)C(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CN1C=CC(=N1)CN(C)C(=O)[C@@H]2CCCC[C@H]2C(=O)O

InChI

InChI=1S/C14H21N3O3/c1-16(9-10-7-8-17(2)15-10)13(18)11-5-3-4-6-12(11)14(19)20/h7-8,11-12H,3-6,9H2,1-2H3,(H,19,20)/t11-,12-/m1/s1