2-[[4,6-bis(4-methoxyphenyl)pyrimidin-2-yl]amino]benzoic acid

Systemtic Name: 2-[[4,6-bis(4-methoxyphenyl)pyrimidin-2-yl]amino]benzoic acid Openeye Name: 2-[[4,6-bis(4-methoxyphenyl)pyrimidin-2-yl]amino]benzoic acid CAS Name: 2-[[4,6-bis(4-methoxyphenyl)-2-pyrimidinyl]amino]benzoic acid IUPAC Name: 2-[[4,6-bis(4-methoxyphenyl)pyrimidin-2-yl]amino]benzoic acid Traditional Name: 2-[[4,6-bis(4-methoxyphenyl)pyrimidin-2-yl]amino]benzoic acid Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=N2)NC3=CC=CC=C3C(=O)O)C4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=N2)NC3=CC=CC=C3C(=O)O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H21N3O4/c1-31-18-11-7-16(8-12-18)22-15-23(17-9-13-19(32-2)14-10-17)28-25(27-22)26-21-6-4-3-5-20(21)24(29)30/h3-15H,1-2H3,(H,29,30)(H,26,27,28)