2-chloranyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-5-piperidinosulfonyl-benzamide Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H23ClN2O5S/c22-18-9-8-16(30(26,27)24-10-4-1-5-11-24)12-17(18)21(25)23-13-15-14-28-19-6-2-3-7-20(19)29-15/h2-3,6-9,12,15H,1,4-5,10-11,13-14H2,(H,23,25)