3-methyl-2-[(1-phenylpyrazol-4-yl)methylamino]butanoic acid

Systemtic Name: 3-methyl-2-[(1-phenylpyrazol-4-yl)methylamino]butanoic acid Openeye Name: 3-methyl-2-[(1-phenylpyrazol-4-yl)methylamino]butanoic acid CAS Name: 3-methyl-2-[(1-phenyl-4-pyrazolyl)methylamino]butanoic acid IUPAC Name: 3-methyl-2-[(1-phenylpyrazol-4-yl)methylamino]butanoic acid Traditional Name: 3-methyl-2-[(1-phenylpyrazol-4-yl)methylamino]butyric acid Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O2/c1-11(2)14(15(19)20)16-8-12-9-17-18(10-12)13-6-4-3-5-7-13/h3-7,9-11,14,16H,8H2,1-2H3,(H,19,20)