2-[4-(1,3-benzoxazol-2-yl)-3-chloranyl-phenyl]propanoic acid

Systemtic Name: 2-[4-(1,3-benzoxazol-2-yl)-3-chloranyl-phenyl]propanoic acid Openeye Name: 2-[4-(1,3-benzoxazol-2-yl)-3-chloro-phenyl]propanoic acid CAS Name: 2-[4-(1,3-benzoxazol-2-yl)-3-chlorophenyl]propanoic acid IUPAC Name: 2-[4-(1,3-benzoxazol-2-yl)-3-chlorophenyl]propanoic acid Traditional Name: 2-[4-(1,3-benzoxazol-2-yl)-3-chloro-phenyl]propionic acid Formula: C16H12ClNO3 MolecularWeight: 301.72438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)C2=NC3=CC=CC=C3O2)Cl)C(=O)O

Isomeric SMILES

CC(C1=CC(=C(C=C1)C2=NC3=CC=CC=C3O2)Cl)C(=O)O

InChI

InChI=1S/C16H12ClNO3/c1-9(16(19)20)10-6-7-11(12(17)8-10)15-18-13-4-2-3-5-14(13)21-15/h2-9H,1H3,(H,19,20)