7-fluoranyl-2-(4-fluorophenyl)-5-(4-propoxyphenyl)-4H-1,3,4-benzotriazepine

Systemtic Name: 7-fluoranyl-2-(4-fluorophenyl)-5-(4-propoxyphenyl)-4H-1,3,4-benzotriazepine Openeye Name: 7-fluoro-2-(4-fluorophenyl)-5-(4-propoxyphenyl)-4H-1,3,4-benzotriazepine CAS Name: 7-fluoro-2-(4-fluorophenyl)-5-(4-propoxyphenyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-fluoro-2-(4-fluorophenyl)-5-(4-propoxyphenyl)-4H-1,3,4-benzotriazepine Traditional Name: 7-fluoro-2-(4-fluorophenyl)-5-(4-propoxyphenyl)-4H-1,3,4-benzotriazepine Formula: C23H19F2N3O MolecularWeight: 391.413266

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=C(C=C4)F)F

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=C(C=C4)F)F

InChI

InChI=1S/C23H19F2N3O/c1-2-13-29-19-10-5-15(6-11-19)22-20-14-18(25)9-12-21(20)26-23(28-27-22)16-3-7-17(24)8-4-16/h3-12,14,27H,2,13H2,1H3