2-[2-(3,4-dimethylphenyl)carbonyl-1,3-benzoxazol-5-yl]propanoic acid

Systemtic Name: 2-[2-(3,4-dimethylphenyl)carbonyl-1,3-benzoxazol-5-yl]propanoic acid Openeye Name: 2-[2-(3,4-dimethylbenzoyl)-1,3-benzoxazol-5-yl]propanoic acid CAS Name: 2-[2-[(3,4-dimethylphenyl)-oxomethyl]-1,3-benzoxazol-5-yl]propanoic acid IUPAC Name: 2-[2-(3,4-dimethylbenzoyl)-1,3-benzoxazol-5-yl]propanoic acid Traditional Name: 2-[2-(3,4-dimethylbenzoyl)-1,3-benzoxazol-5-yl]propionic acid Formula: C19H17NO4 MolecularWeight: 323.34258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C2=NC3=C(O2)C=CC(=C3)C(C)C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C2=NC3=C(O2)C=CC(=C3)C(C)C(=O)O)C

InChI

InChI=1S/C19H17NO4/c1-10-4-5-14(8-11(10)2)17(21)18-20-15-9-13(12(3)19(22)23)6-7-16(15)24-18/h4-9,12H,1-3H3,(H,22,23)