2-(4-bromophenyl)-7-ethoxy-5-phenyl-4H-1,3,4-benzotriazepine

Systemtic Name: 2-(4-bromophenyl)-7-ethoxy-5-phenyl-4H-1,3,4-benzotriazepine Openeye Name: 2-(4-bromophenyl)-7-ethoxy-5-phenyl-4H-1,3,4-benzotriazepine CAS Name: 2-(4-bromophenyl)-7-ethoxy-5-phenyl-4H-1,3,4-benzotriazepine IUPAC Name: 2-(4-bromophenyl)-7-ethoxy-5-phenyl-4H-1,3,4-benzotriazepine Traditional Name: 2-(4-bromophenyl)-7-ethoxy-5-phenyl-4H-1,3,4-benzotriazepine Formula: C22H18BrN3O MolecularWeight: 420.30182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H18BrN3O/c1-2-27-18-12-13-20-19(14-18)21(15-6-4-3-5-7-15)25-26-22(24-20)16-8-10-17(23)11-9-16/h3-14,25H,2H2,1H3