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

Systemtic Name: 5-[4-(4-methoxyphenyl)phenyl]-2-phenyl-4H-1,3,4-benzotriazepine Openeye Name: 5-[4-(4-methoxyphenyl)phenyl]-2-phenyl-4H-1,3,4-benzotriazepine CAS Name: 5-[4-(4-methoxyphenyl)phenyl]-2-phenyl-4H-1,3,4-benzotriazepine IUPAC Name: 5-[4-(4-methoxyphenyl)phenyl]-2-phenyl-4H-1,3,4-benzotriazepine Traditional Name: 5-[4-(4-methoxyphenyl)phenyl]-2-phenyl-4H-1,3,4-benzotriazepine Formula: C27H21N3O MolecularWeight: 403.47514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H21N3O/c1-31-23-17-15-20(16-18-23)19-11-13-21(14-12-19)26-24-9-5-6-10-25(24)28-27(30-29-26)22-7-3-2-4-8-22/h2-18,29H,1H3