4-[4-azanyl-5-(4-methoxyphenyl)furo[2,3-d]pyrimidin-6-yl]benzoic acid

Systemtic Name: 4-[4-azanyl-5-(4-methoxyphenyl)furo[2,3-d]pyrimidin-6-yl]benzoic acid Openeye Name: 4-[4-amino-5-(4-methoxyphenyl)furo[2,3-d]pyrimidin-6-yl]benzoic acid CAS Name: 4-[4-amino-5-(4-methoxyphenyl)-6-furo[2,3-d]pyrimidinyl]benzoic acid IUPAC Name: 4-[4-amino-5-(4-methoxyphenyl)furo[2,3-d]pyrimidin-6-yl]benzoic acid Traditional Name: 4-[4-amino-5-(4-methoxyphenyl)furo[2,3-d]pyrimidin-6-yl]benzoic acid Formula: C20H15N3O4 MolecularWeight: 361.3508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(OC3=NC=NC(=C23)N)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(OC3=NC=NC(=C23)N)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C20H15N3O4/c1-26-14-8-6-11(7-9-14)15-16-18(21)22-10-23-19(16)27-17(15)12-2-4-13(5-3-12)20(24)25/h2-10H,1H3,(H,24,25)(H2,21,22,23)