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

Systemtic Name: (5S)-4-azanyl-3-(furan-2-ylmethyl)-5-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol Openeye Name: (5S)-4-amino-3-(2-furylmethyl)-5-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol CAS Name: (5S)-4-amino-3-(2-furanylmethyl)-5-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-3-ium-8-ol IUPAC Name: (5S)-4-amino-3-(furan-2-ylmethyl)-5-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol Traditional Name: (5S)-4-amino-3-(2-furfuryl)-5-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-3-ium-8-ol Formula: C23H20N3O4+ MolecularWeight: 402.4226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C3=C(C=C(C=C3)O)OC4=C2C(=[N+](C=N4)CC5=CC=CO5)N

Isomeric SMILES

COC1=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/C23H19N3O4/c1-28-16-7-4-14(5-8-16)20-18-9-6-15(27)11-19(18)30-23-21(20)22(24)26(13-25-23)12-17-3-2-10-29-17/h2-11,13,20,24,27H,12H2,1H3/p+1/t20-/m0/s1