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

Systemtic Name: 7-methoxy-5-[4-(4-methoxyphenyl)phenyl]-2-pyridin-4-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-methoxy-5-[4-(4-methoxyphenyl)phenyl]-2-(4-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-methoxy-5-[4-(4-methoxyphenyl)phenyl]-2-pyridin-4-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-methoxy-5-[4-(4-methoxyphenyl)phenyl]-2-pyridin-4-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-methoxy-5-[4-(4-methoxyphenyl)phenyl]-2-(4-pyridyl)-4H-1,3,4-benzotriazepine Formula: C27H22N4O2 MolecularWeight: 434.48918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(C=C2)C3=C4C=C(C=CC4=NC(=NN3)C5=CC=NC=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(C=C2)C3=C4C=C(C=CC4=NC(=NN3)C5=CC=NC=C5)OC

InChI

InChI=1S/C27H22N4O2/c1-32-22-9-7-19(8-10-22)18-3-5-20(6-4-18)26-24-17-23(33-2)11-12-25(24)29-27(31-30-26)21-13-15-28-16-14-21/h3-17,30H,1-2H3