ethyl 2-[2-[3-[(4-bromophenyl)carbonylamino]propyl]benzimidazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[2-[3-[(4-bromophenyl)carbonylamino]propyl]benzimidazol-1-yl]ethanoate Openeye Name: ethyl 2-[2-[3-[(4-bromobenzoyl)amino]propyl]benzimidazol-1-yl]acetate CAS Name: 2-[2-[3-[[(4-bromophenyl)-oxomethyl]amino]propyl]-1-benzimidazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-[(4-bromobenzoyl)amino]propyl]benzimidazol-1-yl]acetate Traditional Name: 2-[2-[3-[(4-bromobenzoyl)amino]propyl]benzimidazol-1-yl]acetic acid ethyl ester Formula: C21H22BrN3O3 MolecularWeight: 444.32168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2N=C1CCCNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2N=C1CCCNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H22BrN3O3/c1-2-28-20(26)14-25-18-7-4-3-6-17(18)24-19(25)8-5-13-23-21(27)15-9-11-16(22)12-10-15/h3-4,6-7,9-12H,2,5,8,13-14H2,1H3,(H,23,27)