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

Systemtic Name: 2-(4-ethoxyphenyl)-5-[4-(4-methoxyphenyl)phenyl]-7-propan-2-yl-4H-1,3,4-benzotriazepine Openeye Name: 2-(4-ethoxyphenyl)-7-isopropyl-5-[4-(4-methoxyphenyl)phenyl]-4H-1,3,4-benzotriazepine CAS Name: 2-(4-ethoxyphenyl)-5-[4-(4-methoxyphenyl)phenyl]-7-propan-2-yl-4H-1,3,4-benzotriazepine IUPAC Name: 2-(4-ethoxyphenyl)-5-[4-(4-methoxyphenyl)phenyl]-7-propan-2-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-isopropyl-5-[4-(4-methoxyphenyl)phenyl]-2-p-phenetyl-4H-1,3,4-benzotriazepine Formula: C32H31N3O2 MolecularWeight: 489.60744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)C(C)C)C4=CC=C(C=C4)C5=CC=C(C=C5)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)C(C)C)C4=CC=C(C=C4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C32H31N3O2/c1-5-37-28-17-12-25(13-18-28)32-33-30-19-14-26(21(2)3)20-29(30)31(34-35-32)24-8-6-22(7-9-24)23-10-15-27(36-4)16-11-23/h6-21,34H,5H2,1-4H3