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

Systemtic Name: 4-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]benzoic acid Openeye Name: 4-[(3-morpholinosulfonylbenzoyl)amino]benzoic acid CAS Name: 4-[[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(3-morpholin-4-ylsulfonylbenzoyl)amino]benzoic acid Traditional Name: 4-[(3-morpholinosulfonylbenzoyl)amino]benzoic acid Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O6S/c21-17(19-15-6-4-13(5-7-15)18(22)23)14-2-1-3-16(12-14)27(24,25)20-8-10-26-11-9-20/h1-7,12H,8-11H2,(H,19,21)(H,22,23)