2-[4-chloranyl-2-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-4-methyl-benzenesulfonic acid

Systemtic Name: 2-[4-chloranyl-2-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-4-methyl-benzenesulfonic acid Openeye Name: 2-[4-chloro-2-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-4-methyl-benzenesulfonic acid CAS Name: 2-[4-chloro-2-[[(3,4-dichloroanilino)-oxomethyl]amino]phenoxy]-4-methylbenzenesulfonic acid IUPAC Name: 2-[4-chloro-2-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-4-methylbenzenesulfonic acid Traditional Name: 2-[4-chloro-2-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-4-methyl-besylic acid Formula: C20H15Cl3N2O5S MolecularWeight: 501.7675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)O)OC2=C(C=C(C=C2)Cl)NC(=O)NC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)O)OC2=C(C=C(C=C2)Cl)NC(=O)NC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H15Cl3N2O5S/c1-11-2-7-19(31(27,28)29)18(8-11)30-17-6-3-12(21)9-16(17)25-20(26)24-13-4-5-14(22)15(23)10-13/h2-10H,1H3,(H2,24,25,26)(H,27,28,29)