(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)-(2-methylpropyl)azanium

Systemtic Name: (2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)-(2-methylpropyl)azanium Openeye Name: isobutyl-(2-methylbenzofuro[3,2-d]pyrimidin-4-yl)ammonium CAS Name: (2-methyl-4-benzofuro[3,2-d]pyrimidinyl)-(2-methylpropyl)ammonium IUPAC Name: (2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)-(2-methylpropyl)azanium Traditional Name: isobutyl-(2-methylbenzofuro[3,2-d]pyrimidin-4-yl)ammonium Formula: C15H18N3O+ MolecularWeight: 256.32292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)[NH2+]CC(C)C)OC3=CC=CC=C32

Isomeric SMILES

CC1=NC2=C(C(=N1)[NH2+]CC(C)C)OC3=CC=CC=C32

InChI

InChI=1S/C15H17N3O/c1-9(2)8-16-15-14-13(17-10(3)18-15)11-6-4-5-7-12(11)19-14/h4-7,9H,8H2,1-3H3,(H,16,17,18)/p+1