methyl 2-[(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)amino]-3-(4-hydroxyphenyl)propanoate

Systemtic Name: methyl 2-[(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)amino]-3-(4-hydroxyphenyl)propanoate Openeye Name: methyl 2-[(2-chloro-5-fluoro-pyrimidin-4-yl)amino]-3-(4-hydroxyphenyl)propanoate CAS Name: 2-[(2-chloro-5-fluoro-4-pyrimidinyl)amino]-3-(4-hydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(2-chloro-5-fluoropyrimidin-4-yl)amino]-3-(4-hydroxyphenyl)propanoate Traditional Name: 2-[(2-chloro-5-fluoro-pyrimidin-4-yl)amino]-3-(4-hydroxyphenyl)propionic acid methyl ester Formula: C14H13ClFN3O3 MolecularWeight: 325.722723

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)O)NC2=NC(=NC=C2F)Cl

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)O)NC2=NC(=NC=C2F)Cl

InChI

InChI=1S/C14H13ClFN3O3/c1-22-13(21)11(6-8-2-4-9(20)5-3-8)18-12-10(16)7-17-14(15)19-12/h2-5,7,11,20H,6H2,1H3,(H,17,18,19)