methyl 4-[(5-morpholin-4-ylsulfonyl-2-oxidanyl-phenyl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(5-morpholin-4-ylsulfonyl-2-oxidanyl-phenyl)carbonylamino]benzoate Openeye Name: methyl 4-[(2-hydroxy-5-morpholinosulfonyl-benzoyl)amino]benzoate CAS Name: 4-[[[2-hydroxy-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-hydroxy-5-morpholin-4-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 4-[(2-hydroxy-5-morpholinosulfonyl-benzoyl)amino]benzoic acid methyl ester Formula: C19H20N2O7S MolecularWeight: 420.4363

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)O

InChI

InChI=1S/C19H20N2O7S/c1-27-19(24)13-2-4-14(5-3-13)20-18(23)16-12-15(6-7-17(16)22)29(25,26)21-8-10-28-11-9-21/h2-7,12,22H,8-11H2,1H3,(H,20,23)