2-[2-(3,4-dimethoxyphenyl)-1,3-benzothiazol-6-yl]ethanoic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)-1,3-benzothiazol-6-yl]ethanoic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)-1,3-benzothiazol-6-yl]acetic acid CAS Name: 2-[2-(3,4-dimethoxyphenyl)-1,3-benzothiazol-6-yl]acetic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)-1,3-benzothiazol-6-yl]acetic acid Traditional Name: 2-[2-(3,4-dimethoxyphenyl)-1,3-benzothiazol-6-yl]acetic acid Formula: C17H15NO4S MolecularWeight: 329.3703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(S2)C=C(C=C3)CC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(S2)C=C(C=C3)CC(=O)O)OC

InChI

InChI=1S/C17H15NO4S/c1-21-13-6-4-11(9-14(13)22-2)17-18-12-5-3-10(8-16(19)20)7-15(12)23-17/h3-7,9H,8H2,1-2H3,(H,19,20)