2-[2-[2,5-bis(chloranyl)phenyl]sulfanylethanoylamino]terephthalic acid

Systemtic Name: 2-[2-[2,5-bis(chloranyl)phenyl]sulfanylethanoylamino]terephthalic acid Openeye Name: 2-[[2-(2,5-dichlorophenyl)sulfanylacetyl]amino]terephthalic acid CAS Name: 2-[[2-[(2,5-dichlorophenyl)thio]-1-oxoethyl]amino]terephthalic acid IUPAC Name: 2-[[2-(2,5-dichlorophenyl)sulfanylacetyl]amino]terephthalic acid Traditional Name: 2-[[2-[(2,5-dichlorophenyl)thio]acetyl]amino]terephthalic acid Formula: C16H11Cl2NO5S MolecularWeight: 400.23324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NC(=O)CSC2=C(C=CC(=C2)Cl)Cl)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NC(=O)CSC2=C(C=CC(=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C16H11Cl2NO5S/c17-9-2-4-11(18)13(6-9)25-7-14(20)19-12-5-8(15(21)22)1-3-10(12)16(23)24/h1-6H,7H2,(H,19,20)(H,21,22)(H,23,24)