6-chloranyl-2-[(4-chloranyl-2-methyl-phenyl)carbamoylamino]-3-(4-chloranylphenoxy)benzenesulfonic acid

Systemtic Name: 6-chloranyl-2-[(4-chloranyl-2-methyl-phenyl)carbamoylamino]-3-(4-chloranylphenoxy)benzenesulfonic acid Openeye Name: 6-chloro-2-[(4-chloro-2-methyl-phenyl)carbamoylamino]-3-(4-chlorophenoxy)benzenesulfonic acid CAS Name: 6-chloro-2-[[(4-chloro-2-methylanilino)-oxomethyl]amino]-3-(4-chlorophenoxy)benzenesulfonic acid IUPAC Name: 6-chloro-2-[(4-chloro-2-methylphenyl)carbamoylamino]-3-(4-chlorophenoxy)benzenesulfonic acid Traditional Name: 6-chloro-2-[(4-chloro-2-methyl-phenyl)carbamoylamino]-3-(4-chlorophenoxy)besylic acid Formula: C20H15Cl3N2O5S MolecularWeight: 501.7675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=O)NC2=C(C=CC(=C2S(=O)(=O)O)Cl)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=O)NC2=C(C=CC(=C2S(=O)(=O)O)Cl)OC3=CC=C(C=C3)Cl

InChI

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