(4-cyano-2-methoxy-phenyl) 1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxylate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxylate Openeye Name: (4-cyano-2-methoxy-phenyl) 1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxylate CAS Name: 1-methyl-4-(1-pyrrolidinylsulfonyl)-2-pyrrolecarboxylic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 1-methyl-4-pyrrolidin-1-ylsulfonylpyrrole-2-carboxylate Traditional Name: 1-methyl-4-pyrrolidinosulfonyl-pyrrole-2-carboxylic acid (4-cyano-2-methoxy-phenyl) ester Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC2=C(C=C(C=C2)C#N)OC)S(=O)(=O)N3CCCC3

Isomeric SMILES

CN1C=C(C=C1C(=O)OC2=C(C=C(C=C2)C#N)OC)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H19N3O5S/c1-20-12-14(27(23,24)21-7-3-4-8-21)10-15(20)18(22)26-16-6-5-13(11-19)9-17(16)25-2/h5-6,9-10,12H,3-4,7-8H2,1-2H3