3-(6-azanylpyridin-3-yl)-2-[1-(4-methylpentyl)imidazol-4-yl]propanoic acid

Systemtic Name: 3-(6-azanylpyridin-3-yl)-2-[1-(4-methylpentyl)imidazol-4-yl]propanoic acid Openeye Name: 3-(6-amino-3-pyridyl)-2-(1-isohexylimidazol-4-yl)propanoic acid CAS Name: 3-(6-amino-3-pyridinyl)-2-[1-(4-methylpentyl)-4-imidazolyl]propanoic acid IUPAC Name: 3-(6-aminopyridin-3-yl)-2-[1-(4-methylpentyl)imidazol-4-yl]propanoic acid Traditional Name: 3-(6-amino-3-pyridyl)-2-(1-isohexylimidazol-4-yl)propionic acid Formula: C17H24N4O2 MolecularWeight: 316.39806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCN1C=C(N=C1)C(CC2=CN=C(C=C2)N)C(=O)O

Isomeric SMILES

CC(C)CCCN1C=C(N=C1)C(CC2=CN=C(C=C2)N)C(=O)O

InChI

InChI=1S/C17H24N4O2/c1-12(2)4-3-7-21-10-15(20-11-21)14(17(22)23)8-13-5-6-16(18)19-9-13/h5-6,9-12,14H,3-4,7-8H2,1-2H3,(H2,18,19)(H,22,23)