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

Systemtic Name: 2-[3-(benzimidazol-1-yl)propanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[3-(benzimidazol-1-yl)propanoylamino]-3-methyl-butanoic acid CAS Name: 2-[[3-(1-benzimidazolyl)-1-oxopropyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[3-(benzimidazol-1-yl)propanoylamino]-3-methylbutanoic acid Traditional Name: 2-[3-(benzimidazol-1-yl)propanoylamino]-3-methyl-butyric acid Formula: C15H19N3O3 MolecularWeight: 289.32966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CCN1C=NC2=CC=CC=C21

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CCN1C=NC2=CC=CC=C21

InChI

InChI=1S/C15H19N3O3/c1-10(2)14(15(20)21)17-13(19)7-8-18-9-16-11-5-3-4-6-12(11)18/h3-6,9-10,14H,7-8H2,1-2H3,(H,17,19)(H,20,21)