6-azanyl-6-(1-phenylpyrazol-4-yl)hexanoic acid

Systemtic Name: 6-azanyl-6-(1-phenylpyrazol-4-yl)hexanoic acid Openeye Name: 6-amino-6-(1-phenylpyrazol-4-yl)hexanoic acid CAS Name: 6-amino-6-(1-phenyl-4-pyrazolyl)hexanoic acid IUPAC Name: 6-amino-6-(1-phenylpyrazol-4-yl)hexanoic acid Traditional Name: 6-amino-6-(1-phenylpyrazol-4-yl)hexanoic acid Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O2/c16-14(8-4-5-9-15(19)20)12-10-17-18(11-12)13-6-2-1-3-7-13/h1-3,6-7,10-11,14H,4-5,8-9,16H2,(H,19,20)