2-[2-[2,4-bis(chloranyl)phenoxy]ethanoylcarbamothioylamino]benzoic acid

Systemtic Name: 2-[2-[2,4-bis(chloranyl)phenoxy]ethanoylcarbamothioylamino]benzoic acid Openeye Name: 2-[[2-(2,4-dichlorophenoxy)acetyl]carbamothioylamino]benzoic acid CAS Name: 2-[[[[2-(2,4-dichlorophenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 2-[[2-(2,4-dichlorophenoxy)acetyl]carbamothioylamino]benzoic acid Traditional Name: 2-[[2-(2,4-dichlorophenoxy)acetyl]thiocarbamoylamino]benzoic acid Formula: C16H12Cl2N2O4S MolecularWeight: 399.24848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=S)NC(=O)COC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=S)NC(=O)COC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H12Cl2N2O4S/c17-9-5-6-13(11(18)7-9)24-8-14(21)20-16(25)19-12-4-2-1-3-10(12)15(22)23/h1-7H,8H2,(H,22,23)(H2,19,20,21,25)