2-[[4-[(2,4-dichlorophenyl)carbonylamino]phenyl]sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[4-[(2,4-dichlorophenyl)carbonylamino]phenyl]sulfonylamino]-3-methyl-butanoic acid Openeye Name: 2-[[4-[(2,4-dichlorobenzoyl)amino]phenyl]sulfonylamino]-3-methyl-butanoic acid CAS Name: 2-[[4-[[(2,4-dichlorophenyl)-oxomethyl]amino]phenyl]sulfonylamino]-3-methylbutanoic acid IUPAC Name: 2-[[4-[(2,4-dichlorobenzoyl)amino]phenyl]sulfonylamino]-3-methylbutanoic acid Traditional Name: 2-[[4-[(2,4-dichlorobenzoyl)amino]phenyl]sulfonylamino]-3-methyl-butyric acid Formula: C18H18Cl2N2O5S MolecularWeight: 445.31692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H18Cl2N2O5S/c1-10(2)16(18(24)25)22-28(26,27)13-6-4-12(5-7-13)21-17(23)14-8-3-11(19)9-15(14)20/h3-10,16,22H,1-2H3,(H,21,23)(H,24,25)