2-[carboxy-[2-(3-phenylazanylimidazol-4-yl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[carboxy-[2-(3-phenylazanylimidazol-4-yl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[2-(3-anilinoimidazol-4-yl)ethyl-carboxy-amino]-4-methyl-pentanoic acid CAS Name: 2-[2-(3-anilino-4-imidazolyl)ethyl-carboxyamino]-4-methylpentanoic acid IUPAC Name: 2-[2-(3-anilinoimidazol-4-yl)ethyl-carboxyamino]-4-methylpentanoic acid Traditional Name: 2-[2-(3-anilinoimidazol-4-yl)ethyl-carboxy-amino]-4-methyl-valeric acid Formula: C18H24N4O4 MolecularWeight: 360.40756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CN=CN1NC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CN=CN1NC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H24N4O4/c1-13(2)10-16(17(23)24)21(18(25)26)9-8-15-11-19-12-22(15)20-14-6-4-3-5-7-14/h3-7,11-13,16,20H,8-10H2,1-2H3,(H,23,24)(H,25,26)