7-fluoranyl-2-methyl-6-phenyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride

Systemtic Name: 7-fluoranyl-2-methyl-6-phenyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride Openeye Name: 7-fluoro-2-methyl-6-phenyl-4-(1-piperidyl)-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride CAS Name: 7-fluoro-2-methyl-6-phenyl-4-(1-piperidinyl)-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride IUPAC Name: 7-fluoro-2-methyl-6-phenyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride Traditional Name: 7-fluoro-2-methyl-6-phenyl-4-piperidino-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride Formula: C18H20ClFN4 MolecularWeight: 346.829603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N3CCCCC3)[NH2+]C(=C2F)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CC1=NC2=C(C(=N1)N3CCCCC3)[NH2+]C(=C2F)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C18H19FN4.ClH/c1-12-20-16-14(19)15(13-8-4-2-5-9-13)22-17(16)18(21-12)23-10-6-3-7-11-23;/h2,4-5,8-9,22H,3,6-7,10-11H2,1H3;1H