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2-[5-(4-chloranyl-3-methyl-phenyl)-1,2-oxazol-4-yl]propanoic acid

2-[5-(4-chloranyl-3-methyl-phenyl)-1,2-oxazol-4-yl]propanoic acid

Systemtic Name:2-[5-(4-chloranyl-3-methyl-phenyl)-1,2-oxazol-4-yl]propanoic acid
Openeye Name:2-[5-(4-chloro-3-methyl-phenyl)isoxazol-4-yl]propanoic acid
CAS Name:2-[5-(4-chloro-3-methylphenyl)-4-isoxazolyl]propanoic acid
IUPAC Name:2-[5-(4-chloro-3-methylphenyl)-1,2-oxazol-4-yl]propanoic acid
Traditional Name:2-[5-(4-chloro-3-methyl-phenyl)isoxazol-4-yl]propionic acid
Formula: C13H12ClNO3
MolecularWeight: 265.69228
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=C(C=NO2)C(C)C(=O)O)Cl


Isomeric SMILES

CC1=C(C=CC(=C1)C2=C(C=NO2)C(C)C(=O)O)Cl


InChI

InChI=1S/C13H12ClNO3/c1-7-5-9(3-4-11(7)14)12-10(6-15-18-12)8(2)13(16)17/h3-6,8H,1-2H3,(H,16,17)


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