5-chloranyl-2-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]benzoic acid

Systemtic Name: 5-chloranyl-2-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]benzoic acid Openeye Name: 5-chloro-2-[(3-morpholinosulfonylbenzoyl)amino]benzoic acid CAS Name: 5-chloro-2-[[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 5-chloro-2-[(3-morpholin-4-ylsulfonylbenzoyl)amino]benzoic acid Traditional Name: 5-chloro-2-[(3-morpholinosulfonylbenzoyl)amino]benzoic acid Formula: C18H17ClN2O6S MolecularWeight: 424.85538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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