2-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]acetic acid CAS Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)thio]acetic acid IUPAC Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]acetic acid Traditional Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)thio]acetic acid Formula: C9H6ClNO3S MolecularWeight: 243.66684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=C(O2)SCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=C(O2)SCC(=O)O

InChI

InChI=1S/C9H6ClNO3S/c10-5-1-2-7-6(3-5)11-9(14-7)15-4-8(12)13/h1-3H,4H2,(H,12,13)