4-cyano-N-[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]-2-fluoranyl-benzamide

Systemtic Name: 4-cyano-N-[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]-2-fluoranyl-benzamide Openeye Name: 4-cyano-N-[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]-2-fluoro-benzamide CAS Name: 4-cyano-N-[2-(4-ethoxyphenyl)-6-methyl-5-benzotriazolyl]-2-fluorobenzamide IUPAC Name: 4-cyano-N-[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]-2-fluorobenzamide Traditional Name: 4-cyano-2-fluoro-N-(6-methyl-2-p-phenetyl-benzotriazol-5-yl)benzamide Formula: C23H18FN5O2 MolecularWeight: 415.419723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=C(C=C(C=C4)C#N)F)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=C(C=C(C=C4)C#N)F)C

InChI

InChI=1S/C23H18FN5O2/c1-3-31-17-7-5-16(6-8-17)29-27-21-10-14(2)20(12-22(21)28-29)26-23(30)18-9-4-15(13-25)11-19(18)24/h4-12H,3H2,1-2H3,(H,26,30)