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1-methyl-4-[(3S)-3-methylpiperidin-1-yl]carbonyl-pyrazole-3-carboxylic acid

1-methyl-4-[(3S)-3-methylpiperidin-1-yl]carbonyl-pyrazole-3-carboxylic acid

Systemtic Name:1-methyl-4-[(3S)-3-methylpiperidin-1-yl]carbonyl-pyrazole-3-carboxylic acid
Openeye Name:1-methyl-4-[(3S)-3-methylpiperidine-1-carbonyl]pyrazole-3-carboxylic acid
CAS Name:1-methyl-4-[[(3S)-3-methyl-1-piperidinyl]-oxomethyl]-3-pyrazolecarboxylic acid
IUPAC Name:1-methyl-4-[(3S)-3-methylpiperidine-1-carbonyl]pyrazole-3-carboxylic acid
Traditional Name:1-methyl-4-[(3S)-3-methylpiperidine-1-carbonyl]pyrazole-3-carboxylic acid
Formula: C12H17N3O3
MolecularWeight: 251.28168
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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CN(N=C2C(=O)O)C


Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)C2=CN(N=C2C(=O)O)C


InChI

InChI=1S/C12H17N3O3/c1-8-4-3-5-15(6-8)11(16)9-7-14(2)13-10(9)12(17)18/h7-8H,3-6H2,1-2H3,(H,17,18)/t8-/m0/s1


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