2-fluoranyl-4-phenylmethoxy-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine

Systemtic Name: 2-fluoranyl-4-phenylmethoxy-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine Openeye Name: 4-benzyloxy-2-fluoro-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine CAS Name: 2-fluoro-4-phenylmethoxy-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine IUPAC Name: 2-fluoro-4-phenylmethoxy-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine Traditional Name: 4-benzoxy-2-fluoro-6,7,8,9-tetrahydro-5H-pyrimid[4,5-d]azepine Formula: C15H16FN3O MolecularWeight: 273.305443

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC2=C1C(=NC(=N2)F)OCC3=CC=CC=C3

Isomeric SMILES

C1CNCCC2=C1C(=NC(=N2)F)OCC3=CC=CC=C3

InChI

InChI=1S/C15H16FN3O/c16-15-18-13-7-9-17-8-6-12(13)14(19-15)20-10-11-4-2-1-3-5-11/h1-5,17H,6-10H2