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

Systemtic Name: 5-(3,4-dimethoxyphenyl)-7-ethoxy-2-phenyl-4H-1,3,4-benzotriazepine Openeye Name: 5-(3,4-dimethoxyphenyl)-7-ethoxy-2-phenyl-4H-1,3,4-benzotriazepine CAS Name: 5-(3,4-dimethoxyphenyl)-7-ethoxy-2-phenyl-4H-1,3,4-benzotriazepine IUPAC Name: 5-(3,4-dimethoxyphenyl)-7-ethoxy-2-phenyl-4H-1,3,4-benzotriazepine Traditional Name: 5-(3,4-dimethoxyphenyl)-7-ethoxy-2-phenyl-4H-1,3,4-benzotriazepine Formula: C24H23N3O3 MolecularWeight: 401.45772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23N3O3/c1-4-30-18-11-12-20-19(15-18)23(17-10-13-21(28-2)22(14-17)29-3)26-27-24(25-20)16-8-6-5-7-9-16/h5-15,26H,4H2,1-3H3