[(1S)-2-oxidanylidenecyclohexyl] 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: [(1S)-2-oxocyclohexyl] 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid [(1S)-2-ketocyclohexyl] ester Formula: C17H21NO5S MolecularWeight: 351.41734

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

C1CCC(=O)[C@H](C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H21NO5S/c19-15-8-1-2-9-16(15)23-17(20)13-6-5-7-14(12-13)24(21,22)18-10-3-4-11-18/h5-7,12,16H,1-4,8-11H2/t16-/m0/s1