2-[2-(3,4-dimethoxyphenyl)-1,3-dihydroinden-2-yl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)-1,3-dihydroinden-2-yl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)indan-2-yl]thiazole-4-carboxylic acid CAS Name: 2-[2-(3,4-dimethoxyphenyl)-1,3-dihydroinden-2-yl]-4-thiazolecarboxylic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)-1,3-dihydroinden-2-yl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[2-(3,4-dimethoxyphenyl)indan-2-yl]thiazole-4-carboxylic acid Formula: C21H19NO4S MolecularWeight: 381.44486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CC3=CC=CC=C3C2)C4=NC(=CS4)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CC3=CC=CC=C3C2)C4=NC(=CS4)C(=O)O)OC

InChI

InChI=1S/C21H19NO4S/c1-25-17-8-7-15(9-18(17)26-2)21(20-22-16(12-27-20)19(23)24)10-13-5-3-4-6-14(13)11-21/h3-9,12H,10-11H2,1-2H3,(H,23,24)