1,3-benzodioxol-5-yl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: 1,3-benzodioxol-5-yl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: 1,3-benzodioxol-5-yl 2-chloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 2-chloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-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=CC(=C(C=C2)Cl)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

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

InChI

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