dimethyl 5-[(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[4-methoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(4-methoxy-3-pyrrolidinosulfonyl-benzoyl)amino]benzene-1,3-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)C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)S(=O)(=O)N3CCCC3

InChI

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