2-[[3-[(2-bromophenyl)carbamoylamino]-6-chloranyl-2-oxidanyl-phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[3-[(2-bromophenyl)carbamoylamino]-6-chloranyl-2-oxidanyl-phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[3-[(2-bromophenyl)carbamoylamino]-6-chloro-2-hydroxy-phenyl]sulfonylamino]acetic acid CAS Name: 2-[[3-[[(2-bromoanilino)-oxomethyl]amino]-6-chloro-2-hydroxyphenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[3-[(2-bromophenyl)carbamoylamino]-6-chloro-2-hydroxyphenyl]sulfonylamino]acetic acid Traditional Name: 2-[[3-[(2-bromophenyl)carbamoylamino]-6-chloro-2-hydroxy-phenyl]sulfonylamino]acetic acid Formula: C15H13BrClN3O6S MolecularWeight: 478.70222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)NC2=C(C(=C(C=C2)Cl)S(=O)(=O)NCC(=O)O)O)Br

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)NC2=C(C(=C(C=C2)Cl)S(=O)(=O)NCC(=O)O)O)Br

InChI

InChI=1S/C15H13BrClN3O6S/c16-8-3-1-2-4-10(8)19-15(24)20-11-6-5-9(17)14(13(11)23)27(25,26)18-7-12(21)22/h1-6,18,23H,7H2,(H,21,22)(H2,19,20,24)