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

Systemtic Name: (2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)-(1-oxidanylbutan-2-yl)azanium Openeye Name: (2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)-[1-(hydroxymethyl)propyl]ammonium CAS Name: (2-ethyl-4-benzofuro[3,2-d]pyrimidinyl)-(1-hydroxybutan-2-yl)ammonium IUPAC Name: (2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)-(1-hydroxybutan-2-yl)azanium Traditional Name: (2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)-(1-methylolpropyl)ammonium Formula: C16H20N3O2+ MolecularWeight: 286.3489

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O2/c1-3-10(9-20)17-16-15-14(18-13(4-2)19-16)11-7-5-6-8-12(11)21-15/h5-8,10,20H,3-4,9H2,1-2H3,(H,17,18,19)/p+1