methyl 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-3-(hydroxymethyl)-2-oxidanyl-benzoate

Systemtic Name: methyl 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-3-(hydroxymethyl)-2-oxidanyl-benzoate Openeye Name: methyl 5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-2-hydroxy-3-(hydroxymethyl)benzoate CAS Name: 5-[2-(3,4-diethoxyphenyl)-4-thiazolyl]-2-hydroxy-3-(hydroxymethyl)benzoic acid methyl ester IUPAC Name: methyl 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2-hydroxy-3-(hydroxymethyl)benzoate Traditional Name: 5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-2-hydroxy-3-methylol-benzoic acid methyl ester Formula: C22H23NO6S MolecularWeight: 429.48612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=C(C(=C3)CO)O)C(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=C(C(=C3)CO)O)C(=O)OC)OCC

InChI

InChI=1S/C22H23NO6S/c1-4-28-18-7-6-13(10-19(18)29-5-2)21-23-17(12-30-21)14-8-15(11-24)20(25)16(9-14)22(26)27-3/h6-10,12,24-25H,4-5,11H2,1-3H3