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

Systemtic Name: 2-methylpropyl-(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)azanium Openeye Name: isobutyl-(2-phenylbenzofuro[3,2-d]pyrimidin-4-yl)ammonium CAS Name: 2-methylpropyl-(2-phenyl-4-benzofuro[3,2-d]pyrimidinyl)ammonium IUPAC Name: 2-methylpropyl-(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)azanium Traditional Name: isobutyl-(2-phenylbenzofuro[3,2-d]pyrimidin-4-yl)ammonium Formula: C20H20N3O+ MolecularWeight: 318.3923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]C1=NC(=NC2=C1OC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C)C[NH2+]C1=NC(=NC2=C1OC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C20H19N3O/c1-13(2)12-21-20-18-17(15-10-6-7-11-16(15)24-18)22-19(23-20)14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,21,22,23)/p+1