2-(3-chloranyl-4-hexoxy-5-methoxy-phenyl)-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: 2-(3-chloranyl-4-hexoxy-5-methoxy-phenyl)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: 2-(3-chloro-4-hexoxy-5-methoxy-phenyl)-4-methyl-thiazole-5-carboxylate CAS Name: 2-(3-chloro-4-hexoxy-5-methoxyphenyl)-4-methyl-5-thiazolecarboxylate IUPAC Name: 2-(3-chloro-4-hexoxy-5-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(3-chloro-4-hexoxy-5-methoxy-phenyl)-4-methyl-thiazole-5-carboxylate Formula: C18H21ClNO4S- MolecularWeight: 382.88164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Cl)C2=NC(=C(S2)C(=O)[O-])C)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Cl)C2=NC(=C(S2)C(=O)[O-])C)OC

InChI

InChI=1S/C18H22ClNO4S/c1-4-5-6-7-8-24-15-13(19)9-12(10-14(15)23-3)17-20-11(2)16(25-17)18(21)22/h9-10H,4-8H2,1-3H3,(H,21,22)/p-1