hydron; methyl 2-(2-azanylidene-3-prop-2-enyl-benzimidazol-1-yl)ethanoate; bromide

Systemtic Name: hydron; methyl 2-(2-azanylidene-3-prop-2-enyl-benzimidazol-1-yl)ethanoate; bromide Openeye Name: hydron; methyl 2-(3-allyl-2-imino-benzimidazol-1-yl)acetate; bromide CAS Name: hydron; 2-(2-imino-3-prop-2-enyl-1-benzimidazolyl)acetic acid methyl ester; bromide IUPAC Name: hydron; methyl 2-(2-imino-3-prop-2-enylbenzimidazol-1-yl)acetate; bromide Traditional Name: 2-(3-allyl-2-imino-benzimidazol-1-yl)acetic acid methyl ester; hydron; bromide Formula: C13H16BrN3O2 MolecularWeight: 326.18904

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Descriptors Computed from Structure

Canonical SMILES:

[H+].COC(=O)CN1C2=CC=CC=C2N(C1=N)CC=C.[Br-]

Isomeric SMILES

[H+].COC(=O)CN1C2=CC=CC=C2N(C1=N)CC=C.[Br-]

InChI

InChI=1S/C13H15N3O2.BrH/c1-3-8-15-10-6-4-5-7-11(10)16(13(15)14)9-12(17)18-2;/h3-7,14H,1,8-9H2,2H3;1H