7,7-dimethyl-1-phenethyl-2-phenyl-N-(phenylmethyl)-5,8-dihydropyrano[4,3-d]pyrimidin-1-ium-4-amine iodide

Systemtic Name: 7,7-dimethyl-1-phenethyl-2-phenyl-N-(phenylmethyl)-5,8-dihydropyrano[4,3-d]pyrimidin-1-ium-4-amine iodide Openeye Name: N-benzyl-7,7-dimethyl-1-phenethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidin-1-ium-4-amine iodide CAS Name: 7,7-dimethyl-1-phenethyl-2-phenyl-N-(phenylmethyl)-5,8-dihydropyrano[4,3-d]pyrimidin-1-ium-4-amine iodide IUPAC Name: N-benzyl-7,7-dimethyl-1-phenethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidin-1-ium-4-amine iodide Traditional Name: benzyl-(7,7-dimethyl-1-phenethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidin-1-ium-4-yl)amine iodide Formula: C30H32IN3O MolecularWeight: 577.49905

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(CO1)C(=NC(=[N+]2CCC3=CC=CC=C3)C4=CC=CC=C4)NCC5=CC=CC=C5)C.[I-]

Isomeric SMILES

CC1(CC2=C(CO1)C(=NC(=[N+]2CCC3=CC=CC=C3)C4=CC=CC=C4)NCC5=CC=CC=C5)C.[I-]

InChI

InChI=1S/C30H31N3O.HI/c1-30(2)20-27-26(22-34-30)28(31-21-24-14-8-4-9-15-24)32-29(25-16-10-5-11-17-25)33(27)19-18-23-12-6-3-7-13-23;/h3-17H,18-22H2,1-2H3;1H