methyl 2-[4-[2-(2-azanylidene-3-ethyl-benzimidazol-1-yl)ethanoyl]phenoxy]ethanoate hydrobromide

Systemtic Name: methyl 2-[4-[2-(2-azanylidene-3-ethyl-benzimidazol-1-yl)ethanoyl]phenoxy]ethanoate hydrobromide Openeye Name: methyl 2-[4-[2-(3-ethyl-2-imino-benzimidazol-1-yl)acetyl]phenoxy]acetate hydrobromide CAS Name: 2-[4-[2-(3-ethyl-2-imino-1-benzimidazolyl)-1-oxoethyl]phenoxy]acetic acid methyl ester hydrobromide IUPAC Name: methyl 2-[4-[2-(3-ethyl-2-iminobenzimidazol-1-yl)acetyl]phenoxy]acetate hydrobromide Traditional Name: 2-[4-[2-(3-ethyl-2-imino-benzimidazol-1-yl)acetyl]phenoxy]acetic acid methyl ester hydrobromide Formula: C20H22BrN3O4 MolecularWeight: 448.31038

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=N)CC(=O)C3=CC=C(C=C3)OCC(=O)OC.Br

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=N)CC(=O)C3=CC=C(C=C3)OCC(=O)OC.Br

InChI

InChI=1S/C20H21N3O4.BrH/c1-3-22-16-6-4-5-7-17(16)23(20(22)21)12-18(24)14-8-10-15(11-9-14)27-13-19(25)26-2;/h4-11,21H,3,12-13H2,1-2H3;1H