methyl 2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]ethanoate hydrobromide

Systemtic Name: methyl 2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]ethanoate hydrobromide Openeye Name: methyl 2-(3-benzyl-2-imino-benzimidazol-1-yl)acetate hydrobromide CAS Name: 2-[2-imino-3-(phenylmethyl)-1-benzimidazolyl]acetic acid methyl ester hydrobromide IUPAC Name: methyl 2-(3-benzyl-2-iminobenzimidazol-1-yl)acetate hydrobromide Traditional Name: 2-(3-benzyl-2-imino-benzimidazol-1-yl)acetic acid methyl ester hydrobromide Formula: C17H18BrN3O2 MolecularWeight: 376.24772

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=CC=CC=C2N(C1=N)CC3=CC=CC=C3.Br

Isomeric SMILES

COC(=O)CN1C2=CC=CC=C2N(C1=N)CC3=CC=CC=C3.Br

InChI

InChI=1S/C17H17N3O2.BrH/c1-22-16(21)12-20-15-10-6-5-9-14(15)19(17(20)18)11-13-7-3-2-4-8-13;/h2-10,18H,11-12H2,1H3;1H