7-chloranyl-5-(4-ethoxyphenyl)-2-(4-methylphenyl)-4H-1,3,4-benzotriazepine

Systemtic Name: 7-chloranyl-5-(4-ethoxyphenyl)-2-(4-methylphenyl)-4H-1,3,4-benzotriazepine Openeye Name: 7-chloro-5-(4-ethoxyphenyl)-2-(p-tolyl)-4H-1,3,4-benzotriazepine CAS Name: 7-chloro-5-(4-ethoxyphenyl)-2-(4-methylphenyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-chloro-5-(4-ethoxyphenyl)-2-(4-methylphenyl)-4H-1,3,4-benzotriazepine Traditional Name: 7-chloro-5-p-phenetyl-2-(p-tolyl)-4H-1,3,4-benzotriazepine Formula: C23H20ClN3O MolecularWeight: 389.8774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=C(C=C4)C)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=C(C=C4)C)Cl

InChI

InChI=1S/C23H20ClN3O/c1-3-28-19-11-8-16(9-12-19)22-20-14-18(24)10-13-21(20)25-23(27-26-22)17-6-4-15(2)5-7-17/h4-14,26H,3H2,1-2H3