2-(4-hexoxy-3-methoxy-phenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: 2-(4-hexoxy-3-methoxy-phenyl)-1,3-thiazole-4-carboxylate Openeye Name: 2-(4-hexoxy-3-methoxy-phenyl)thiazole-4-carboxylate CAS Name: 2-(4-hexoxy-3-methoxyphenyl)-4-thiazolecarboxylate IUPAC Name: 2-(4-hexoxy-3-methoxyphenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(4-hexoxy-3-methoxy-phenyl)thiazole-4-carboxylate Formula: C17H20NO4S- MolecularWeight: 334.41

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO4S/c1-3-4-5-6-9-22-14-8-7-12(10-15(14)21-2)16-18-13(11-23-16)17(19)20/h7-8,10-11H,3-6,9H2,1-2H3,(H,19,20)/p-1