1,3-benzodioxol-5-yl 1-(phenylsulfonyl)piperidine-2-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl 1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: 1,3-benzodioxol-5-yl 1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: 1-(benzenesulfonyl)-2-piperidinecarboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: 1-besylpipecolinic acid 1,3-benzodioxol-5-yl ester Formula: C19H19NO6S MolecularWeight: 389.42226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C(C1)C(=O)OC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H19NO6S/c21-19(26-14-9-10-17-18(12-14)25-13-24-17)16-8-4-5-11-20(16)27(22,23)15-6-2-1-3-7-15/h1-3,6-7,9-10,12,16H,4-5,8,11,13H2