3-(4-azanyl-5,6-diphenyl-furo[2,3-d]pyrimidin-3-ium-3-yl)propan-1-ol

Systemtic Name: 3-(4-azanyl-5,6-diphenyl-furo[2,3-d]pyrimidin-3-ium-3-yl)propan-1-ol Openeye Name: 3-(4-amino-5,6-diphenyl-furo[2,3-d]pyrimidin-3-ium-3-yl)propan-1-ol CAS Name: 3-(4-amino-5,6-diphenyl-3-furo[2,3-d]pyrimidin-3-iumyl)-1-propanol IUPAC Name: 3-(4-amino-5,6-diphenylfuro[2,3-d]pyrimidin-3-ium-3-yl)propan-1-ol Traditional Name: 3-(4-amino-5,6-diphenyl-furo[2,3-d]pyrimidin-3-ium-3-yl)propan-1-ol Formula: C21H20N3O2+ MolecularWeight: 346.4024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC3=C2C(=[N+](C=N3)CCCO)N)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC3=C2C(=[N+](C=N3)CCCO)N)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O2/c22-20-18-17(15-8-3-1-4-9-15)19(16-10-5-2-6-11-16)26-21(18)23-14-24(20)12-7-13-25/h1-6,8-11,14,22,25H,7,12-13H2/p+1