4-[(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]benzoic acid

Systemtic Name: 4-[(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]benzoic acid Openeye Name: 4-[(2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzoyl)amino]benzoic acid CAS Name: 4-[[[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(2-methoxy-5-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoic acid Traditional Name: 4-[(2-methoxy-5-pyrrolidinosulfonyl-benzoyl)amino]benzoic acid Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H20N2O6S/c1-27-17-9-8-15(28(25,26)21-10-2-3-11-21)12-16(17)18(22)20-14-6-4-13(5-7-14)19(23)24/h4-9,12H,2-3,10-11H2,1H3,(H,20,22)(H,23,24)