4-[[2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-phenyl]carbonylamino]benzoic acid

Systemtic Name: 4-[[2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-phenyl]carbonylamino]benzoic acid Openeye Name: 4-[(2,4-dichloro-5-morpholinosulfonyl-benzoyl)amino]benzoic acid CAS Name: 4-[[[2,4-dichloro-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(2,4-dichloro-5-morpholin-4-ylsulfonylbenzoyl)amino]benzoic acid Traditional Name: 4-[(2,4-dichloro-5-morpholinosulfonyl-benzoyl)amino]benzoic acid Formula: C18H16Cl2N2O6S MolecularWeight: 459.30044

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=C(C(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)Cl)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=C(C(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)Cl)Cl

InChI

InChI=1S/C18H16Cl2N2O6S/c19-14-10-15(20)16(29(26,27)22-5-7-28-8-6-22)9-13(14)17(23)21-12-3-1-11(2-4-12)18(24)25/h1-4,9-10H,5-8H2,(H,21,23)(H,24,25)