ethyl 2-[2-azanyl-3-(2-bromanyl-4-propan-2-yl-phenyl)-2H-benzimidazol-1-yl]ethanoate bromide

Systemtic Name: ethyl 2-[2-azanyl-3-(2-bromanyl-4-propan-2-yl-phenyl)-2H-benzimidazol-1-yl]ethanoate bromide Openeye Name: ethyl 2-[2-amino-3-(2-bromo-4-isopropyl-phenyl)-2H-benzimidazol-1-yl]acetate bromide CAS Name: 2-[2-amino-3-(2-bromo-4-propan-2-ylphenyl)-2H-benzimidazol-1-yl]acetic acid ethyl ester bromide IUPAC Name: ethyl 2-[2-amino-3-(2-bromo-4-propan-2-ylphenyl)-2H-benzimidazol-1-yl]acetate bromide Traditional Name: 2-[2-amino-3-(2-bromo-4-isopropyl-phenyl)-2H-benzimidazol-1-yl]acetic acid ethyl ester bromide Formula: C20H24Br2N3O2- MolecularWeight: 498.23146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(N(C2=CC=CC=C21)C3=C(C=C(C=C3)C(C)C)Br)N.[Br-]

Isomeric SMILES

CCOC(=O)CN1C(N(C2=CC=CC=C21)C3=C(C=C(C=C3)C(C)C)Br)N.[Br-]

InChI

InChI=1S/C20H24BrN3O2.BrH/c1-4-26-19(25)12-23-17-7-5-6-8-18(17)24(20(23)22)16-10-9-14(13(2)3)11-15(16)21;/h5-11,13,20H,4,12,22H2,1-3H3;1H/p-1