3-bromanyl-N-[2-(4-dimethylaminophenyl)benzotriazol-5-yl]benzamide

Systemtic Name: 3-bromanyl-N-[2-(4-dimethylaminophenyl)benzotriazol-5-yl]benzamide Openeye Name: 3-bromo-N-[2-(4-dimethylaminophenyl)benzotriazol-5-yl]benzamide CAS Name: 3-bromo-N-[2-(4-dimethylaminophenyl)-5-benzotriazolyl]benzamide IUPAC Name: 3-bromo-N-[2-(4-dimethylaminophenyl)benzotriazol-5-yl]benzamide Traditional Name: 3-bromo-N-[2-(4-dimethylaminophenyl)benzotriazol-5-yl]benzamide Formula: C21H18BrN5O MolecularWeight: 436.30452

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CN(C)C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H18BrN5O/c1-26(2)17-7-9-18(10-8-17)27-24-19-11-6-16(13-20(19)25-27)23-21(28)14-4-3-5-15(22)12-14/h3-13H,1-2H3,(H,23,28)