3-[5-(heptan-2-ylcarbamoyl)pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[5-(heptan-2-ylcarbamoyl)pyrazol-1-yl]propanoic acid Openeye Name: 3-[5-(1-methylhexylcarbamoyl)pyrazol-1-yl]propanoic acid CAS Name: 3-[5-[(heptan-2-ylamino)-oxomethyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[5-(heptan-2-ylcarbamoyl)pyrazol-1-yl]propanoic acid Traditional Name: 3-[5-(1-methylhexylcarbamoyl)pyrazol-1-yl]propionic acid Formula: C14H23N3O3 MolecularWeight: 281.35072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C1=CC=NN1CCC(=O)O

Isomeric SMILES

CCCCCC(C)NC(=O)C1=CC=NN1CCC(=O)O

InChI

InChI=1S/C14H23N3O3/c1-3-4-5-6-11(2)16-14(20)12-7-9-15-17(12)10-8-13(18)19/h7,9,11H,3-6,8,10H2,1-2H3,(H,16,20)(H,18,19)