dimethyl 2-[(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[(2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzoyl)amino]benzene-1,4-dicarboxylate CAS Name: 2-[[[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(2-methoxy-5-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzene-1,4-dicarboxylate Traditional Name: 2-[(2-methoxy-5-pyrrolidinosulfonyl-benzoyl)amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C22H24N2O8S MolecularWeight: 476.49956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O8S/c1-30-19-9-7-15(33(28,29)24-10-4-5-11-24)13-17(19)20(25)23-18-12-14(21(26)31-2)6-8-16(18)22(27)32-3/h6-9,12-13H,4-5,10-11H2,1-3H3,(H,23,25)