2-[4-(3-methylbutylcarbamoyl)pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-(3-methylbutylcarbamoyl)pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-(isopentylcarbamoyl)pyrazol-1-yl]acetic acid CAS Name: 2-[4-[(3-methylbutylamino)-oxomethyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-(3-methylbutylcarbamoyl)pyrazol-1-yl]acetic acid Traditional Name: 2-[4-(isoamylcarbamoyl)pyrazol-1-yl]acetic acid Formula: C11H17N3O3 MolecularWeight: 239.27098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CN(N=C1)CC(=O)O

Isomeric SMILES

CC(C)CCNC(=O)C1=CN(N=C1)CC(=O)O

InChI

InChI=1S/C11H17N3O3/c1-8(2)3-4-12-11(17)9-5-13-14(6-9)7-10(15)16/h5-6,8H,3-4,7H2,1-2H3,(H,12,17)(H,15,16)