2-[4-[[(1R,2S)-2-methylcyclohexyl]carbamoyl]pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-[[(1R,2S)-2-methylcyclohexyl]carbamoyl]pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-[[(1R,2S)-2-methylcyclohexyl]carbamoyl]pyrazol-1-yl]acetic acid CAS Name: 2-[4-[[[(1R,2S)-2-methylcyclohexyl]amino]-oxomethyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-[[(1R,2S)-2-methylcyclohexyl]carbamoyl]pyrazol-1-yl]acetic acid Traditional Name: 2-[4-[[(1R,2S)-2-methylcyclohexyl]carbamoyl]pyrazol-1-yl]acetic acid Formula: C13H19N3O3 MolecularWeight: 265.30826

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C2=CN(N=C2)CC(=O)O

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC(=O)C2=CN(N=C2)CC(=O)O

InChI

InChI=1S/C13H19N3O3/c1-9-4-2-3-5-11(9)15-13(19)10-6-14-16(7-10)8-12(17)18/h6-7,9,11H,2-5,8H2,1H3,(H,15,19)(H,17,18)/t9-,11+/m0/s1