(5S)-4-azanyl-5-phenyl-3-(phenylmethyl)-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol

Systemtic Name: (5S)-4-azanyl-5-phenyl-3-(phenylmethyl)-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol Openeye Name: (5S)-4-amino-3-benzyl-5-phenyl-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol CAS Name: (5S)-4-amino-5-phenyl-3-(phenylmethyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-3-ium-8-ol IUPAC Name: (5S)-4-amino-3-benzyl-5-phenyl-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol Traditional Name: (5S)-4-amino-3-benzyl-5-phenyl-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol Formula: C24H20N3O2+ MolecularWeight: 382.4345

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(C3=C(N=C2)OC4=C(C3C5=CC=CC=C5)C=CC(=C4)O)N

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(C3=C(N=C2)OC4=C([C@@H]3C5=CC=CC=C5)C=CC(=C4)O)N

InChI

InChI=1S/C24H19N3O2/c25-23-22-21(17-9-5-2-6-10-17)19-12-11-18(28)13-20(19)29-24(22)26-15-27(23)14-16-7-3-1-4-8-16/h1-13,15,21,25,28H,14H2/p+1/t21-/m0/s1