naphthalen-1-ylmethyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: naphthalen-1-ylmethyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: 1-naphthylmethyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid 1-naphthylmethyl ester Formula: C22H21NO4S MolecularWeight: 395.47144

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H21NO4S/c24-22(27-16-19-8-5-7-17-6-1-2-9-21(17)19)18-10-12-20(13-11-18)28(25,26)23-14-3-4-15-23/h1-2,5-13H,3-4,14-16H2