(4-tert-butylphenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (4-tert-butylphenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (4-tert-butylphenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid (4-tert-butylbenzyl) ester Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H27NO4S/c1-22(2,3)19-10-6-17(7-11-19)16-27-21(24)18-8-12-20(13-9-18)28(25,26)23-14-4-5-15-23/h6-13H,4-5,14-16H2,1-3H3