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

Systemtic Name: 3-[4-(3-methylbutylcarbamoyl)pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-(isopentylcarbamoyl)pyrazol-1-yl]propanoic acid CAS Name: 3-[4-[(3-methylbutylamino)-oxomethyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-(3-methylbutylcarbamoyl)pyrazol-1-yl]propanoic acid Traditional Name: 3-[4-(isoamylcarbamoyl)pyrazol-1-yl]propionic acid Formula: C12H19N3O3 MolecularWeight: 253.29756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N3O3/c1-9(2)3-5-13-12(18)10-7-14-15(8-10)6-4-11(16)17/h7-9H,3-6H2,1-2H3,(H,13,18)(H,16,17)