2-[4-(1,2-benzoxazol-3-yl)-2,3-dimethyl-phenoxy]butanoic acid

Systemtic Name: 2-[4-(1,2-benzoxazol-3-yl)-2,3-dimethyl-phenoxy]butanoic acid Openeye Name: 2-[4-(1,2-benzoxazol-3-yl)-2,3-dimethyl-phenoxy]butanoic acid CAS Name: 2-[4-(1,2-benzoxazol-3-yl)-2,3-dimethylphenoxy]butanoic acid IUPAC Name: 2-[4-(1,2-benzoxazol-3-yl)-2,3-dimethylphenoxy]butanoic acid Traditional Name: 2-(4-indoxazen-3-yl-2,3-dimethyl-phenoxy)butyric acid Formula: C19H19NO4 MolecularWeight: 325.35846

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)OC1=C(C(=C(C=C1)C2=NOC3=CC=CC=C32)C)C

Isomeric SMILES

CCC(C(=O)O)OC1=C(C(=C(C=C1)C2=NOC3=CC=CC=C32)C)C

InChI

InChI=1S/C19H19NO4/c1-4-15(19(21)22)23-16-10-9-13(11(2)12(16)3)18-14-7-5-6-8-17(14)24-20-18/h5-10,15H,4H2,1-3H3,(H,21,22)