2-[2-(benzimidazol-1-yl)ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-(benzimidazol-1-yl)ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(benzimidazol-1-yl)acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(1-benzimidazolyl)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(benzimidazol-1-yl)acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(benzimidazol-1-yl)acetyl]amino]-3-methyl-butyric acid Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CN1C=NC2=CC=CC=C21

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CN1C=NC2=CC=CC=C21

InChI

InChI=1S/C14H17N3O3/c1-9(2)13(14(19)20)16-12(18)7-17-8-15-10-5-3-4-6-11(10)17/h3-6,8-9,13H,7H2,1-2H3,(H,16,18)(H,19,20)