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

Systemtic Name: 5-cyclopropyl-7-fluoranyl-2-(4-methoxyphenyl)-4H-1,3,4-benzotriazepine Openeye Name: 5-cyclopropyl-7-fluoro-2-(4-methoxyphenyl)-4H-1,3,4-benzotriazepine CAS Name: 5-cyclopropyl-7-fluoro-2-(4-methoxyphenyl)-4H-1,3,4-benzotriazepine IUPAC Name: 5-cyclopropyl-7-fluoro-2-(4-methoxyphenyl)-4H-1,3,4-benzotriazepine Traditional Name: 5-cyclopropyl-7-fluoro-2-(4-methoxyphenyl)-4H-1,3,4-benzotriazepine Formula: C18H16FN3O MolecularWeight: 309.337543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)F)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)F)C4CC4

InChI

InChI=1S/C18H16FN3O/c1-23-14-7-4-12(5-8-14)18-20-16-9-6-13(19)10-15(16)17(21-22-18)11-2-3-11/h4-11,21H,2-3H2,1H3