3-(6-azanyl-5-methyl-pyridin-3-yl)-2-[1-(3-methylbutyl)imidazol-4-yl]propanoic acid

Systemtic Name: 3-(6-azanyl-5-methyl-pyridin-3-yl)-2-[1-(3-methylbutyl)imidazol-4-yl]propanoic acid Openeye Name: 3-(6-amino-5-methyl-3-pyridyl)-2-(1-isopentylimidazol-4-yl)propanoic acid CAS Name: 3-(6-amino-5-methyl-3-pyridinyl)-2-[1-(3-methylbutyl)-4-imidazolyl]propanoic acid IUPAC Name: 3-(6-amino-5-methylpyridin-3-yl)-2-[1-(3-methylbutyl)imidazol-4-yl]propanoic acid Traditional Name: 3-(6-amino-5-methyl-3-pyridyl)-2-(1-isoamylimidazol-4-yl)propionic acid Formula: C17H24N4O2 MolecularWeight: 316.39806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC(=C1)CC(C2=CN(C=N2)CCC(C)C)C(=O)O)N

Isomeric SMILES

CC1=C(N=CC(=C1)CC(C2=CN(C=N2)CCC(C)C)C(=O)O)N

InChI

InChI=1S/C17H24N4O2/c1-11(2)4-5-21-9-15(20-10-21)14(17(22)23)7-13-6-12(3)16(18)19-8-13/h6,8-11,14H,4-5,7H2,1-3H3,(H2,18,19)(H,22,23)