3-bromanyl-N-[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]benzamide

Systemtic Name: 3-bromanyl-N-[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]benzamide Openeye Name: 3-bromo-N-[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]benzamide CAS Name: 3-bromo-N-[2-(4-methoxyphenyl)-6-methyl-5-benzotriazolyl]benzamide IUPAC Name: 3-bromo-N-[2-(4-methoxyphenyl)-6-methylbenzotriazol-5-yl]benzamide Traditional Name: 3-bromo-N-[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]benzamide Formula: C21H17BrN4O2 MolecularWeight: 437.28928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC(=CC=C3)Br)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC(=CC=C3)Br)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H17BrN4O2/c1-13-10-19-20(25-26(24-19)16-6-8-17(28-2)9-7-16)12-18(13)23-21(27)14-4-3-5-15(22)11-14/h3-12H,1-2H3,(H,23,27)