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

Systemtic Name: 4-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylamino]benzoic acid Openeye Name: 4-[(2-chloro-5-morpholinosulfonyl-benzoyl)amino]benzoic acid CAS Name: 4-[[[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(2-chloro-5-morpholin-4-ylsulfonylbenzoyl)amino]benzoic acid Traditional Name: 4-[(2-chloro-5-morpholinosulfonyl-benzoyl)amino]benzoic acid Formula: C18H17ClN2O6S MolecularWeight: 424.85538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN2O6S/c19-16-6-5-14(28(25,26)21-7-9-27-10-8-21)11-15(16)17(22)20-13-3-1-12(2-4-13)18(23)24/h1-6,11H,7-10H2,(H,20,22)(H,23,24)