2-(3,4-dimethoxyphenyl)-1,3-benzoxazole-5-carboxylic acid

Systemtic Name: 2-(3,4-dimethoxyphenyl)-1,3-benzoxazole-5-carboxylic acid Openeye Name: 2-(3,4-dimethoxyphenyl)-1,3-benzoxazole-5-carboxylic acid CAS Name: 2-(3,4-dimethoxyphenyl)-1,3-benzoxazole-5-carboxylic acid IUPAC Name: 2-(3,4-dimethoxyphenyl)-1,3-benzoxazole-5-carboxylic acid Traditional Name: 2-(3,4-dimethoxyphenyl)-1,3-benzoxazole-5-carboxylic acid Formula: C16H13NO5 MolecularWeight: 299.27812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C(=O)O)OC

InChI

InChI=1S/C16H13NO5/c1-20-13-6-3-9(8-14(13)21-2)15-17-11-7-10(16(18)19)4-5-12(11)22-15/h3-8H,1-2H3,(H,18,19)