[(1S)-2,3-dihydro-1H-inden-1-yl] 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: [(1S)-2,3-dihydro-1H-inden-1-yl] 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: [(1S)-indan-1-yl] 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid [(1S)-2,3-dihydro-1H-inden-1-yl] ester IUPAC Name: [(1S)-2,3-dihydro-1H-inden-1-yl] 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid [(1S)-indan-1-yl] ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3CCC4=CC=CC=C34

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)O[C@H]3CCC4=CC=CC=C34

InChI

InChI=1S/C20H21NO4S/c22-20(25-19-12-9-15-5-1-2-6-18(15)19)16-7-10-17(11-8-16)26(23,24)21-13-3-4-14-21/h1-2,5-8,10-11,19H,3-4,9,12-14H2/t19-/m0/s1