2-[(1-phenylpyrazol-4-yl)methylamino]propanoic acid

Systemtic Name: 2-[(1-phenylpyrazol-4-yl)methylamino]propanoic acid Openeye Name: 2-[(1-phenylpyrazol-4-yl)methylamino]propanoic acid CAS Name: 2-[(1-phenyl-4-pyrazolyl)methylamino]propanoic acid IUPAC Name: 2-[(1-phenylpyrazol-4-yl)methylamino]propanoic acid Traditional Name: 2-[(1-phenylpyrazol-4-yl)methylamino]propionic acid Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NCC1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)O)NCC1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C13H15N3O2/c1-10(13(17)18)14-7-11-8-15-16(9-11)12-5-3-2-4-6-12/h2-6,8-10,14H,7H2,1H3,(H,17,18)