7-fluoranyl-2,5-bis(4-methoxyphenyl)-4H-1,3,4-benzotriazepine

Systemtic Name: 7-fluoranyl-2,5-bis(4-methoxyphenyl)-4H-1,3,4-benzotriazepine Openeye Name: 7-fluoro-2,5-bis(4-methoxyphenyl)-4H-1,3,4-benzotriazepine CAS Name: 7-fluoro-2,5-bis(4-methoxyphenyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-fluoro-2,5-bis(4-methoxyphenyl)-4H-1,3,4-benzotriazepine Traditional Name: 7-fluoro-2,5-bis(4-methoxyphenyl)-4H-1,3,4-benzotriazepine Formula: C22H18FN3O2 MolecularWeight: 375.395623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=C(C=C4)OC)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=C(C=C4)OC)F

InChI

InChI=1S/C22H18FN3O2/c1-27-17-8-3-14(4-9-17)21-19-13-16(23)7-12-20(19)24-22(26-25-21)15-5-10-18(28-2)11-6-15/h3-13,25H,1-2H3