3-[3-[(phenylmethyl)carbamoyl]pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[3-[(phenylmethyl)carbamoyl]pyrazol-1-yl]propanoic acid Openeye Name: 3-[3-(benzylcarbamoyl)pyrazol-1-yl]propanoic acid CAS Name: 3-[3-[oxo-[(phenylmethyl)amino]methyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[3-(benzylcarbamoyl)pyrazol-1-yl]propanoic acid Traditional Name: 3-[3-(benzylcarbamoyl)pyrazol-1-yl]propionic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=NN(C=C2)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=NN(C=C2)CCC(=O)O

InChI

InChI=1S/C14H15N3O3/c18-13(19)7-9-17-8-6-12(16-17)14(20)15-10-11-4-2-1-3-5-11/h1-6,8H,7,9-10H2,(H,15,20)(H,18,19)