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

Systemtic Name: 5-[4-(4-methoxyphenyl)phenyl]-2-(4-propan-2-ylphenyl)-4H-1,3,4-benzotriazepine Openeye Name: 2-(4-isopropylphenyl)-5-[4-(4-methoxyphenyl)phenyl]-4H-1,3,4-benzotriazepine CAS Name: 5-[4-(4-methoxyphenyl)phenyl]-2-(4-propan-2-ylphenyl)-4H-1,3,4-benzotriazepine IUPAC Name: 5-[4-(4-methoxyphenyl)phenyl]-2-(4-propan-2-ylphenyl)-4H-1,3,4-benzotriazepine Traditional Name: 5-[4-(4-methoxyphenyl)phenyl]-2-p-cumenyl-4H-1,3,4-benzotriazepine Formula: C30H27N3O MolecularWeight: 445.55488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NNC(=C3C=CC=CC3=N2)C4=CC=C(C=C4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NNC(=C3C=CC=CC3=N2)C4=CC=C(C=C4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C30H27N3O/c1-20(2)21-8-14-25(15-9-21)30-31-28-7-5-4-6-27(28)29(32-33-30)24-12-10-22(11-13-24)23-16-18-26(34-3)19-17-23/h4-20,32H,1-3H3