2-[2-[5-chloranyl-2-(3-phenylpropoxy)phenyl]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[5-chloranyl-2-(3-phenylpropoxy)phenyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[5-chloro-2-(3-phenylpropoxy)phenyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[5-chloro-2-(3-phenylpropoxy)phenyl]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[5-chloro-2-(3-phenylpropoxy)phenyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[5-chloro-2-(3-phenylpropoxy)phenyl]thiazol-4-yl]acetic acid Formula: C20H18ClNO3S MolecularWeight: 387.87982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)Cl)C3=NC(=CS3)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)Cl)C3=NC(=CS3)CC(=O)O

InChI

InChI=1S/C20H18ClNO3S/c21-15-8-9-18(25-10-4-7-14-5-2-1-3-6-14)17(11-15)20-22-16(13-26-20)12-19(23)24/h1-3,5-6,8-9,11,13H,4,7,10,12H2,(H,23,24)