2-azanyl-3-(6-chloranyl-1-ethyl-benzimidazol-5-yl)propanoic acid

Systemtic Name: 2-azanyl-3-(6-chloranyl-1-ethyl-benzimidazol-5-yl)propanoic acid Openeye Name: 2-amino-3-(6-chloro-1-ethyl-benzimidazol-5-yl)propanoic acid CAS Name: 2-amino-3-(6-chloro-1-ethyl-5-benzimidazolyl)propanoic acid IUPAC Name: 2-amino-3-(6-chloro-1-ethylbenzimidazol-5-yl)propanoic acid Traditional Name: 2-amino-3-(6-chloro-1-ethyl-benzimidazol-5-yl)propionic acid Formula: C12H14ClN3O2 MolecularWeight: 267.71146

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1C=C(C(=C2)CC(C(=O)O)N)Cl

Isomeric SMILES

CCN1C=NC2=C1C=C(C(=C2)CC(C(=O)O)N)Cl

InChI

InChI=1S/C12H14ClN3O2/c1-2-16-6-15-10-4-7(3-9(14)12(17)18)8(13)5-11(10)16/h4-6,9H,2-3,14H2,1H3,(H,17,18)