5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2-methoxy-3-(propoxymethyl)benzoic acid

Systemtic Name: 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2-methoxy-3-(propoxymethyl)benzoic acid Openeye Name: 5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-2-methoxy-3-(propoxymethyl)benzoic acid CAS Name: 5-[2-(3,4-diethoxyphenyl)-4-thiazolyl]-2-methoxy-3-(propoxymethyl)benzoic acid IUPAC Name: 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2-methoxy-3-(propoxymethyl)benzoic acid Traditional Name: 5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-2-methoxy-3-(propoxymethyl)benzoic acid Formula: C25H29NO6S MolecularWeight: 471.56586

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCC1=CC(=CC(=C1OC)C(=O)O)C2=CSC(=N2)C3=CC(=C(C=C3)OCC)OCC

Isomeric SMILES

CCCOCC1=CC(=CC(=C1OC)C(=O)O)C2=CSC(=N2)C3=CC(=C(C=C3)OCC)OCC

InChI

InChI=1S/C25H29NO6S/c1-5-10-30-14-18-11-17(12-19(25(27)28)23(18)29-4)20-15-33-24(26-20)16-8-9-21(31-6-2)22(13-16)32-7-3/h8-9,11-13,15H,5-7,10,14H2,1-4H3,(H,27,28)