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

Systemtic Name: 4-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)amino]benzoate Openeye Name: 4-[(2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino]benzoate CAS Name: 4-[(2-methyl-4-benzofuro[3,2-d]pyrimidinyl)amino]benzoate IUPAC Name: 4-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)amino]benzoate Traditional Name: 4-[(2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino]benzoate Formula: C18H12N3O3- MolecularWeight: 318.30618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)NC3=CC=C(C=C3)C(=O)[O-])OC4=CC=CC=C42

Isomeric SMILES

CC1=NC2=C(C(=N1)NC3=CC=C(C=C3)C(=O)[O-])OC4=CC=CC=C42

InChI

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