1-[1-(3-phenoxyphenyl)propan-2-yl]-1,4,5,6-tetrahydropyrimidin-1-ium-2-amine chloride

Systemtic Name: 1-[1-(3-phenoxyphenyl)propan-2-yl]-1,4,5,6-tetrahydropyrimidin-1-ium-2-amine chloride Openeye Name: 1-[1-methyl-2-(3-phenoxyphenyl)ethyl]-1,4,5,6-tetrahydropyrimidin-1-ium-2-amine chloride CAS Name: 1-[1-(3-phenoxyphenyl)propan-2-yl]-1,4,5,6-tetrahydropyrimidin-1-ium-2-amine chloride IUPAC Name: 1-[1-(3-phenoxyphenyl)propan-2-yl]-1,4,5,6-tetrahydropyrimidin-1-ium-2-amine chloride Traditional Name: [1-[1-methyl-2-(3-phenoxyphenyl)ethyl]-1,4,5,6-tetrahydropyrimidin-1-ium-2-yl]amine chloride Formula: C19H24ClN3O MolecularWeight: 345.86636

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC=C1)OC2=CC=CC=C2)[NH+]3CCCN=C3N.[Cl-]

Isomeric SMILES

CC(CC1=CC(=CC=C1)OC2=CC=CC=C2)[NH+]3CCCN=C3N.[Cl-]

InChI

InChI=1S/C19H23N3O.ClH/c1-15(22-12-6-11-21-19(22)20)13-16-7-5-10-18(14-16)23-17-8-3-2-4-9-17;/h2-5,7-10,14-15H,6,11-13H2,1H3,(H2,20,21);1H