3-(2-methylpropyl)-5,6-diphenyl-furo[2,3-d]pyrimidin-3-ium-4-amine

Systemtic Name: 3-(2-methylpropyl)-5,6-diphenyl-furo[2,3-d]pyrimidin-3-ium-4-amine Openeye Name: 3-isobutyl-5,6-diphenyl-furo[2,3-d]pyrimidin-3-ium-4-amine CAS Name: 3-(2-methylpropyl)-5,6-diphenyl-4-furo[2,3-d]pyrimidin-3-iumamine IUPAC Name: 3-(2-methylpropyl)-5,6-diphenylfuro[2,3-d]pyrimidin-3-ium-4-amine Traditional Name: (3-isobutyl-5,6-diphenyl-furo[2,3-d]pyrimidin-3-ium-4-yl)amine Formula: C22H22N3O+ MolecularWeight: 344.42958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[N+]1=C(C2=C(N=C1)OC(=C2C3=CC=CC=C3)C4=CC=CC=C4)N

Isomeric SMILES

CC(C)C[N+]1=C(C2=C(N=C1)OC(=C2C3=CC=CC=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C22H21N3O/c1-15(2)13-25-14-24-22-19(21(25)23)18(16-9-5-3-6-10-16)20(26-22)17-11-7-4-8-12-17/h3-12,14-15,23H,13H2,1-2H3/p+1