7-methoxy-2-(4-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]-4H-1,3,4-benzotriazepine

Systemtic Name: 7-methoxy-2-(4-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]-4H-1,3,4-benzotriazepine Openeye Name: 7-methoxy-2-(4-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]-4H-1,3,4-benzotriazepine CAS Name: 7-methoxy-2-(4-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]-4H-1,3,4-benzotriazepine IUPAC Name: 7-methoxy-2-(4-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]-4H-1,3,4-benzotriazepine Traditional Name: 7-methoxy-2-(4-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]-4H-1,3,4-benzotriazepine Formula: C23H18F3N3O2 MolecularWeight: 425.40313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)OC)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)OC)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C23H18F3N3O2/c1-30-17-8-6-14(7-9-17)22-27-20-11-10-18(31-2)13-19(20)21(28-29-22)15-4-3-5-16(12-15)23(24,25)26/h3-13,28H,1-2H3