methyl 3-([1]benzofuro[3,2-d]pyrimidin-4-ylamino)benzoate

Systemtic Name: methyl 3-([1]benzofuro[3,2-d]pyrimidin-4-ylamino)benzoate Openeye Name: methyl 3-(benzofuro[3,2-d]pyrimidin-4-ylamino)benzoate CAS Name: 3-(4-benzofuro[3,2-d]pyrimidinylamino)benzoic acid methyl ester IUPAC Name: methyl 3-([1]benzofuro[3,2-d]pyrimidin-4-ylamino)benzoate Traditional Name: 3-(benzofuro[3,2-d]pyrimidin-4-ylamino)benzoic acid methyl ester Formula: C18H13N3O3 MolecularWeight: 319.31412

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC2=NC=NC3=C2OC4=CC=CC=C43

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC2=NC=NC3=C2OC4=CC=CC=C43

InChI

InChI=1S/C18H13N3O3/c1-23-18(22)11-5-4-6-12(9-11)21-17-16-15(19-10-20-17)13-7-2-3-8-14(13)24-16/h2-10H,1H3,(H,19,20,21)