(5R)-4-azanyl-8,8-dimethyl-5-phenyl-3-(phenylmethyl)-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one

Systemtic Name: (5R)-4-azanyl-8,8-dimethyl-5-phenyl-3-(phenylmethyl)-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one Openeye Name: (5R)-4-amino-3-benzyl-8,8-dimethyl-5-phenyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one CAS Name: (5R)-4-amino-8,8-dimethyl-5-phenyl-3-(phenylmethyl)-7,9-dihydro-5H-[1]benzopyrano[2,3-d]pyrimidin-3-ium-6-one IUPAC Name: (5R)-4-amino-3-benzyl-8,8-dimethyl-5-phenyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one Traditional Name: (5R)-4-amino-3-benzyl-8,8-dimethyl-5-phenyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one Formula: C26H26N3O2+ MolecularWeight: 412.50354

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C3=C(O2)N=C[N+](=C3N)CC4=CC=CC=C4)C5=CC=CC=C5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C([C@@H](C3=C(O2)N=C[N+](=C3N)CC4=CC=CC=C4)C5=CC=CC=C5)C(=O)C1)C

InChI

InChI=1S/C26H25N3O2/c1-26(2)13-19(30)22-20(14-26)31-25-23(21(22)18-11-7-4-8-12-18)24(27)29(16-28-25)15-17-9-5-3-6-10-17/h3-12,16,21,27H,13-15H2,1-2H3/p+1/t21-/m0/s1