5-(5-chloranylthiophen-2-yl)-4-methoxy-2-(1,2-oxazol-3-ylmethoxy)benzoic acid

Systemtic Name: 5-(5-chloranylthiophen-2-yl)-4-methoxy-2-(1,2-oxazol-3-ylmethoxy)benzoic acid Openeye Name: 5-(5-chloro-2-thienyl)-2-(isoxazol-3-ylmethoxy)-4-methoxy-benzoic acid CAS Name: 5-(5-chloro-2-thiophenyl)-2-(3-isoxazolylmethoxy)-4-methoxybenzoic acid IUPAC Name: 5-(5-chlorothiophen-2-yl)-4-methoxy-2-(1,2-oxazol-3-ylmethoxy)benzoic acid Traditional Name: 5-(5-chloro-2-thienyl)-2-(isoxazol-3-ylmethoxy)-4-methoxy-benzoic acid Formula: C16H12ClNO5S MolecularWeight: 365.78818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CC=C(S2)Cl)C(=O)O)OCC3=NOC=C3

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC=C(S2)Cl)C(=O)O)OCC3=NOC=C3

InChI

InChI=1S/C16H12ClNO5S/c1-21-12-7-13(22-8-9-4-5-23-18-9)11(16(19)20)6-10(12)14-2-3-15(17)24-14/h2-7H,8H2,1H3,(H,19,20)