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

Systemtic Name: 2-[carboxy-[2-[3-(phenylmethyl)imidazol-4-yl]ethyl]amino]-3-methyl-pentanoic acid Openeye Name: 2-[2-(3-benzylimidazol-4-yl)ethyl-carboxy-amino]-3-methyl-pentanoic acid CAS Name: 2-[carboxy-[2-[3-(phenylmethyl)-4-imidazolyl]ethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[2-(3-benzylimidazol-4-yl)ethyl-carboxyamino]-3-methylpentanoic acid Traditional Name: 2-[2-(3-benzylimidazol-4-yl)ethyl-carboxy-amino]-3-methyl-valeric acid Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)N(CCC1=CN=CN1CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCC(C)C(C(=O)O)N(CCC1=CN=CN1CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H25N3O4/c1-3-14(2)17(18(23)24)22(19(25)26)10-9-16-11-20-13-21(16)12-15-7-5-4-6-8-15/h4-8,11,13-14,17H,3,9-10,12H2,1-2H3,(H,23,24)(H,25,26)