2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)azaniumyl]ethanoate

Systemtic Name: 2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)azaniumyl]ethanoate Openeye Name: 2-[(2-methylbenzofuro[3,2-d]pyrimidin-4-yl)ammonio]acetate CAS Name: 2-[(2-methyl-4-benzofuro[3,2-d]pyrimidinyl)ammonio]acetate IUPAC Name: 2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)azaniumyl]acetate Traditional Name: 2-[(2-methylbenzofuro[3,2-d]pyrimidin-4-yl)ammonio]acetate Formula: C13H11N3O3 MolecularWeight: 257.24474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O3/c1-7-15-11-8-4-2-3-5-9(8)19-12(11)13(16-7)14-6-10(17)18/h2-5H,6H2,1H3,(H,17,18)(H,14,15,16)