2-(2-azanylidene-3-butyl-benzimidazol-1-yl)ethanoate

Systemtic Name: 2-(2-azanylidene-3-butyl-benzimidazol-1-yl)ethanoate Openeye Name: 2-(3-butyl-2-imino-benzimidazol-1-yl)acetate CAS Name: 2-(3-butyl-2-imino-1-benzimidazolyl)acetate IUPAC Name: 2-(3-butyl-2-iminobenzimidazol-1-yl)acetate Traditional Name: 2-(3-butyl-2-imino-benzimidazol-1-yl)acetate Formula: C13H16N3O2- MolecularWeight: 246.28504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N(C1=N)CC(=O)[O-]

Isomeric SMILES

CCCCN1C2=CC=CC=C2N(C1=N)CC(=O)[O-]

InChI

InChI=1S/C13H17N3O2/c1-2-3-8-15-10-6-4-5-7-11(10)16(13(15)14)9-12(17)18/h4-7,14H,2-3,8-9H2,1H3,(H,17,18)/p-1