(2S)-1-butylsulfonyl-2,3-dihydroindole-2-carboxylate

Systemtic Name: (2S)-1-butylsulfonyl-2,3-dihydroindole-2-carboxylate Openeye Name: (2S)-1-butylsulfonylindoline-2-carboxylate CAS Name: (2S)-1-butylsulfonyl-2,3-dihydroindole-2-carboxylate IUPAC Name: (2S)-1-butylsulfonyl-2,3-dihydroindole-2-carboxylate Traditional Name: (2S)-1-butylsulfonylindoline-2-carboxylate Formula: C13H16NO4S- MolecularWeight: 282.33544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1C(CC2=CC=CC=C21)C(=O)[O-]

Isomeric SMILES

CCCCS(=O)(=O)N1[C@@H](CC2=CC=CC=C21)C(=O)[O-]

InChI

InChI=1S/C13H17NO4S/c1-2-3-8-19(17,18)14-11-7-5-4-6-10(11)9-12(14)13(15)16/h4-7,12H,2-3,8-9H2,1H3,(H,15,16)/p-1/t12-/m0/s1