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

Systemtic Name: 4-[[(4-morpholin-4-ylsulfonylphenyl)carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(4-morpholinosulfonylbenzoyl)amino]methyl]benzoic acid CAS Name: 4-[[[[4-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(4-morpholin-4-ylsulfonylbenzoyl)amino]methyl]benzoic acid Traditional Name: 4-[[(4-morpholinosulfonylbenzoyl)amino]methyl]benzoic acid Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H20N2O6S/c22-18(20-13-14-1-3-16(4-2-14)19(23)24)15-5-7-17(8-6-15)28(25,26)21-9-11-27-12-10-21/h1-8H,9-13H2,(H,20,22)(H,23,24)