5-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)-7-methoxy-4H-1,3,4-benzotriazepine

Systemtic Name: 5-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)-7-methoxy-4H-1,3,4-benzotriazepine Openeye Name: 5-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)-7-methoxy-4H-1,3,4-benzotriazepine CAS Name: 5-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)-7-methoxy-4H-1,3,4-benzotriazepine IUPAC Name: 5-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)-7-methoxy-4H-1,3,4-benzotriazepine Traditional Name: 5-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)-7-methoxy-4H-1,3,4-benzotriazepine Formula: C23H20FN3O3 MolecularWeight: 405.421603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)F)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)F)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C23H20FN3O3/c1-28-17-9-10-19-18(13-17)22(15-6-11-20(29-2)21(12-15)30-3)26-27-23(25-19)14-4-7-16(24)8-5-14/h4-13,26H,1-3H3