3-[[2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-phenyl]carbonylamino]benzoic acid

Systemtic Name: 3-[[2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-phenyl]carbonylamino]benzoic acid Openeye Name: 3-[(2,4-dichloro-5-morpholinosulfonyl-benzoyl)amino]benzoic acid CAS Name: 3-[[[2,4-dichloro-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[(2,4-dichloro-5-morpholin-4-ylsulfonylbenzoyl)amino]benzoic acid Traditional Name: 3-[(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=CC(=C3)C(=O)O)Cl)Cl

Isomeric SMILES

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

InChI

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