(3S)-1-(1,3-benzodioxol-5-ylsulfonyl)piperidine-3-carbaldehyde

Systemtic Name: (3S)-1-(1,3-benzodioxol-5-ylsulfonyl)piperidine-3-carbaldehyde Openeye Name: (3S)-1-(1,3-benzodioxol-5-ylsulfonyl)piperidine-3-carbaldehyde CAS Name: (3S)-1-(1,3-benzodioxol-5-ylsulfonyl)-3-piperidinecarboxaldehyde IUPAC Name: (3S)-1-(1,3-benzodioxol-5-ylsulfonyl)piperidine-3-carbaldehyde Traditional Name: (3S)-1-(1,3-benzodioxol-5-ylsulfonyl)nipecotaldehyde Formula: C13H15NO5S MolecularWeight: 297.3269

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OCO3)C=O

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OCO3)C=O

InChI

InChI=1S/C13H15NO5S/c15-8-10-2-1-5-14(7-10)20(16,17)11-3-4-12-13(6-11)19-9-18-12/h3-4,6,8,10H,1-2,5,7,9H2/t10-/m0/s1