[(1R)-2-oxidanylidenecyclopentyl] 3-(azepan-1-ylsulfonyl)benzoate

Systemtic Name: [(1R)-2-oxidanylidenecyclopentyl] 3-(azepan-1-ylsulfonyl)benzoate Openeye Name: [(1R)-2-oxocyclopentyl] 3-(azepan-1-ylsulfonyl)benzoate CAS Name: 3-(1-azepanylsulfonyl)benzoic acid [(1R)-2-oxocyclopentyl] ester IUPAC Name: [(1R)-2-oxocyclopentyl] 3-(azepan-1-ylsulfonyl)benzoate Traditional Name: 3-(azepan-1-ylsulfonyl)benzoic acid [(1R)-2-ketocyclopentyl] ester Formula: C18H23NO5S MolecularWeight: 365.44392

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3CCCC3=O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)O[C@@H]3CCCC3=O

InChI

InChI=1S/C18H23NO5S/c20-16-9-6-10-17(16)24-18(21)14-7-5-8-15(13-14)25(22,23)19-11-3-1-2-4-12-19/h5,7-8,13,17H,1-4,6,9-12H2/t17-/m1/s1