2-[2-(3-bromanyl-5-methoxy-4-pentoxy-phenyl)-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-(3-bromanyl-5-methoxy-4-pentoxy-phenyl)-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-(3-bromo-5-methoxy-4-pentoxy-phenyl)thiazol-4-yl]acetic acid CAS Name: 2-[2-(3-bromo-5-methoxy-4-pentoxyphenyl)-4-thiazolyl]acetic acid IUPAC Name: 2-[2-(3-bromo-5-methoxy-4-pentoxyphenyl)-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-(4-amoxy-3-bromo-5-methoxy-phenyl)thiazol-4-yl]acetic acid Formula: C17H20BrNO4S MolecularWeight: 414.314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1Br)C2=NC(=CS2)CC(=O)O)OC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1Br)C2=NC(=CS2)CC(=O)O)OC

InChI

InChI=1S/C17H20BrNO4S/c1-3-4-5-6-23-16-13(18)7-11(8-14(16)22-2)17-19-12(10-24-17)9-15(20)21/h7-8,10H,3-6,9H2,1-2H3,(H,20,21)