2-cyclopropyl-8-fluoranyl-4-phenyl-1H-1,3,5-benzotriazepine

Systemtic Name: 2-cyclopropyl-8-fluoranyl-4-phenyl-1H-1,3,5-benzotriazepine Openeye Name: 2-cyclopropyl-8-fluoro-4-phenyl-1H-1,3,5-benzotriazepine CAS Name: 2-cyclopropyl-8-fluoro-4-phenyl-1H-1,3,5-benzotriazepine IUPAC Name: 2-cyclopropyl-8-fluoro-4-phenyl-1H-1,3,5-benzotriazepine Traditional Name: 2-cyclopropyl-8-fluoro-4-phenyl-1H-1,3,5-benzotriazepine Formula: C17H14FN3 MolecularWeight: 279.311563

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NC3=C(N2)C=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

C1CC1C2=NC(=NC3=C(N2)C=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C17H14FN3/c18-13-8-9-14-15(10-13)20-17(12-6-7-12)21-16(19-14)11-4-2-1-3-5-11/h1-5,8-10,12H,6-7H2,(H,19,20,21)