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

Systemtic Name: (2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)-(3-methylbutyl)azanium Openeye Name: isopentyl-(2-methylbenzofuro[3,2-d]pyrimidin-4-yl)ammonium CAS Name: (2-methyl-4-benzofuro[3,2-d]pyrimidinyl)-(3-methylbutyl)ammonium IUPAC Name: (2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)-(3-methylbutyl)azanium Traditional Name: isoamyl-(2-methylbenzofuro[3,2-d]pyrimidin-4-yl)ammonium Formula: C16H20N3O+ MolecularWeight: 270.3495

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O/c1-10(2)8-9-17-16-15-14(18-11(3)19-16)12-6-4-5-7-13(12)20-15/h4-7,10H,8-9H2,1-3H3,(H,17,18,19)/p+1