[(1S)-2-oxidanylidenecyclohexyl] 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate Openeye Name: [(1S)-2-oxocyclohexyl] 3-indolin-1-ylsulfonylbenzoate CAS Name: 3-(2,3-dihydroindol-1-ylsulfonyl)benzoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate Traditional Name: 3-indolin-1-ylsulfonylbenzoic acid [(1S)-2-ketocyclohexyl] ester Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

C1CCC(=O)[C@H](C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C21H21NO5S/c23-19-10-3-4-11-20(19)27-21(24)16-7-5-8-17(14-16)28(25,26)22-13-12-15-6-1-2-9-18(15)22/h1-2,5-9,14,20H,3-4,10-13H2/t20-/m0/s1