12-[[3-(2,4-dichlorophenyl)carbonylphenyl]sulfonylamino]dodecanoic acid

Systemtic Name: 12-[[3-(2,4-dichlorophenyl)carbonylphenyl]sulfonylamino]dodecanoic acid Openeye Name: 12-[[3-(2,4-dichlorobenzoyl)phenyl]sulfonylamino]dodecanoic acid CAS Name: 12-[[3-[(2,4-dichlorophenyl)-oxomethyl]phenyl]sulfonylamino]dodecanoic acid IUPAC Name: 12-[[3-(2,4-dichlorobenzoyl)phenyl]sulfonylamino]dodecanoic acid Traditional Name: 12-[[3-(2,4-dichlorobenzoyl)phenyl]sulfonylamino]lauric acid Formula: C25H31Cl2NO5S MolecularWeight: 528.48834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NCCCCCCCCCCCC(=O)O)C(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NCCCCCCCCCCCC(=O)O)C(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C25H31Cl2NO5S/c26-20-14-15-22(23(27)18-20)25(31)19-11-10-12-21(17-19)34(32,33)28-16-9-7-5-3-1-2-4-6-8-13-24(29)30/h10-12,14-15,17-18,28H,1-9,13,16H2,(H,29,30)