(2,3,5-trimethylphenyl) 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2,3,5-trimethylphenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2,3,5-trimethylphenyl) 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (2,3,5-trimethylphenyl) ester IUPAC Name: (2,3,5-trimethylphenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (2,3,5-trimethylphenyl) ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C)C

InChI

InChI=1S/C20H23NO4S/c1-14-11-15(2)16(3)19(12-14)25-20(22)17-7-6-8-18(13-17)26(23,24)21-9-4-5-10-21/h6-8,11-13H,4-5,9-10H2,1-3H3