1,3-benzodioxol-5-yl 4-chloranyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: 1,3-benzodioxol-5-yl 4-chloranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: 1,3-benzodioxol-5-yl 4-chloro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-chloro-3-(1-piperidinylsulfonyl)benzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 4-chloro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-piperidinosulfonyl-benzoic acid 1,3-benzodioxol-5-yl ester Formula: C19H18ClNO6S MolecularWeight: 423.86732

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC4=C(C=C3)OCO4)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC4=C(C=C3)OCO4)Cl

InChI

InChI=1S/C19H18ClNO6S/c20-15-6-4-13(10-18(15)28(23,24)21-8-2-1-3-9-21)19(22)27-14-5-7-16-17(11-14)26-12-25-16/h4-7,10-11H,1-3,8-9,12H2