4-azanyl-4-(1-phenylpyrazol-4-yl)butanoic acid

Systemtic Name: 4-azanyl-4-(1-phenylpyrazol-4-yl)butanoic acid Openeye Name: 4-amino-4-(1-phenylpyrazol-4-yl)butanoic acid CAS Name: 4-amino-4-(1-phenyl-4-pyrazolyl)butanoic acid IUPAC Name: 4-amino-4-(1-phenylpyrazol-4-yl)butanoic acid Traditional Name: 4-amino-4-(1-phenylpyrazol-4-yl)butyric acid Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C(CCC(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)C(CCC(=O)O)N

InChI

InChI=1S/C13H15N3O2/c14-12(6-7-13(17)18)10-8-15-16(9-10)11-4-2-1-3-5-11/h1-5,8-9,12H,6-7,14H2,(H,17,18)