thiophen-2-ylmethyl 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: thiophen-2-ylmethyl 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: 2-thienylmethyl 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid thiophen-2-ylmethyl ester IUPAC Name: thiophen-2-ylmethyl 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid 2-thenyl ester Formula: C16H17NO4S2 MolecularWeight: 351.44048

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=CS3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=CS3

InChI

InChI=1S/C16H17NO4S2/c18-16(21-12-14-6-4-10-22-14)13-5-3-7-15(11-13)23(19,20)17-8-1-2-9-17/h3-7,10-11H,1-2,8-9,12H2