3-bromanyl-N-[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]-4-ethoxy-benzamide

Systemtic Name: 3-bromanyl-N-[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]-4-ethoxy-benzamide Openeye Name: 3-bromo-N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]-4-ethoxy-benzamide CAS Name: 3-bromo-N-[2-(4-butylphenyl)-6-chloro-5-benzotriazolyl]-4-ethoxybenzamide IUPAC Name: 3-bromo-N-[2-(4-butylphenyl)-6-chlorobenzotriazol-5-yl]-4-ethoxybenzamide Traditional Name: 3-bromo-N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]-4-ethoxy-benzamide Formula: C25H24BrClN4O2 MolecularWeight: 527.84066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=CC(=C(C=C4)OCC)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=CC(=C(C=C4)OCC)Br

InChI

InChI=1S/C25H24BrClN4O2/c1-3-5-6-16-7-10-18(11-8-16)31-29-22-14-20(27)21(15-23(22)30-31)28-25(32)17-9-12-24(33-4-2)19(26)13-17/h7-15H,3-6H2,1-2H3,(H,28,32)