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

Systemtic Name: 2-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylamino]benzoic acid Openeye Name: 2-[(2-methyl-5-morpholinosulfonyl-benzoyl)amino]benzoic acid CAS Name: 2-[[[2-methyl-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[(2-methyl-5-morpholin-4-ylsulfonylbenzoyl)amino]benzoic acid Traditional Name: 2-[(2-methyl-5-morpholinosulfonyl-benzoyl)amino]benzoic acid Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H20N2O6S/c1-13-6-7-14(28(25,26)21-8-10-27-11-9-21)12-16(13)18(22)20-17-5-3-2-4-15(17)19(23)24/h2-7,12H,8-11H2,1H3,(H,20,22)(H,23,24)