(4-cyano-2-methoxy-phenyl) 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (4-cyano-2-methoxy-phenyl) 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (4-cyano-2-methoxy-phenyl) ester Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O5S/c1-25-18-11-14(13-20)7-8-17(18)26-19(22)15-5-4-6-16(12-15)27(23,24)21-9-2-3-10-21/h4-8,11-12H,2-3,9-10H2,1H3