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

Systemtic Name: methyl 2-[2-[3-[(3-bromophenyl)carbonylamino]propyl]benzimidazol-1-yl]ethanoate Openeye Name: methyl 2-[2-[3-[(3-bromobenzoyl)amino]propyl]benzimidazol-1-yl]acetate CAS Name: 2-[2-[3-[[(3-bromophenyl)-oxomethyl]amino]propyl]-1-benzimidazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[3-[(3-bromobenzoyl)amino]propyl]benzimidazol-1-yl]acetate Traditional Name: 2-[2-[3-[(3-bromobenzoyl)amino]propyl]benzimidazol-1-yl]acetic acid methyl ester Formula: C20H20BrN3O3 MolecularWeight: 430.2951

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=CC=CC=C2N=C1CCCNC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

COC(=O)CN1C2=CC=CC=C2N=C1CCCNC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H20BrN3O3/c1-27-19(25)13-24-17-9-3-2-8-16(17)23-18(24)10-5-11-22-20(26)14-6-4-7-15(21)12-14/h2-4,6-9,12H,5,10-11,13H2,1H3,(H,22,26)