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

Systemtic Name: (2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)-(3-methylbutyl)azanium Openeye Name: (2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)-isopentyl-ammonium CAS Name: (2-ethyl-4-benzofuro[3,2-d]pyrimidinyl)-(3-methylbutyl)ammonium IUPAC Name: (2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)-(3-methylbutyl)azanium Traditional Name: (2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)-isoamyl-ammonium Formula: C17H22N3O+ MolecularWeight: 284.37608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=N1)[NH2+]CCC(C)C)OC3=CC=CC=C32

Isomeric SMILES

CCC1=NC2=C(C(=N1)[NH2+]CCC(C)C)OC3=CC=CC=C32

InChI

InChI=1S/C17H21N3O/c1-4-14-19-15-12-7-5-6-8-13(12)21-16(15)17(20-14)18-10-9-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,18,19,20)/p+1