2-[2-(4-hexoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]ethanoate

Systemtic Name: 2-[2-(4-hexoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]ethanoate Openeye Name: 2-[2-(4-hexoxy-3-methoxy-phenyl)thiazol-4-yl]acetate CAS Name: 2-[2-(4-hexoxy-3-methoxyphenyl)-4-thiazolyl]acetate IUPAC Name: 2-[2-(4-hexoxy-3-methoxyphenyl)-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-(4-hexoxy-3-methoxy-phenyl)thiazol-4-yl]acetate Formula: C18H22NO4S- MolecularWeight: 348.43658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C2=NC(=CS2)CC(=O)[O-])OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C2=NC(=CS2)CC(=O)[O-])OC

InChI

InChI=1S/C18H23NO4S/c1-3-4-5-6-9-23-15-8-7-13(10-16(15)22-2)18-19-14(12-24-18)11-17(20)21/h7-8,10,12H,3-6,9,11H2,1-2H3,(H,20,21)/p-1