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

Systemtic Name: (5S)-4-azanyl-3-(furan-2-ylmethyl)-5-phenyl-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol Openeye Name: (5S)-4-amino-3-(2-furylmethyl)-5-phenyl-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol CAS Name: (5S)-4-amino-3-(2-furanylmethyl)-5-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-3-ium-8-ol IUPAC Name: (5S)-4-amino-3-(furan-2-ylmethyl)-5-phenyl-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol Traditional Name: (5S)-4-amino-3-(2-furfuryl)-5-phenyl-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol Formula: C22H18N3O3+ MolecularWeight: 372.39662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C3=C(C=C(C=C3)O)OC4=C2C(=[N+](C=N4)CC5=CC=CO5)N

Isomeric SMILES

C1=CC=C(C=C1)[C@H]2C3=C(C=C(C=C3)O)OC4=C2C(=[N+](C=N4)CC5=CC=CO5)N

InChI

InChI=1S/C22H17N3O3/c23-21-20-19(14-5-2-1-3-6-14)17-9-8-15(26)11-18(17)28-22(20)24-13-25(21)12-16-7-4-10-27-16/h1-11,13,19,23,26H,12H2/p+1/t19-/m0/s1