propyl 4-[2-[(3-hydroxyphenyl)amino]pyrimidin-4-yl]-2-oxidanyl-benzoate

Systemtic Name: propyl 4-[2-[(3-hydroxyphenyl)amino]pyrimidin-4-yl]-2-oxidanyl-benzoate Openeye Name: propyl 2-hydroxy-4-[2-(3-hydroxyanilino)pyrimidin-4-yl]benzoate CAS Name: 2-hydroxy-4-[2-(3-hydroxyanilino)-4-pyrimidinyl]benzoic acid propyl ester IUPAC Name: propyl 2-hydroxy-4-[2-(3-hydroxyanilino)pyrimidin-4-yl]benzoate Traditional Name: 2-hydroxy-4-[2-(3-hydroxyanilino)pyrimidin-4-yl]benzoic acid propyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C=C(C=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)O)O

Isomeric SMILES

CCCOC(=O)C1=C(C=C(C=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)O)O

InChI

InChI=1S/C20H19N3O4/c1-2-10-27-19(26)16-7-6-13(11-18(16)25)17-8-9-21-20(23-17)22-14-4-3-5-15(24)12-14/h3-9,11-12,24-25H,2,10H2,1H3,(H,21,22,23)