2-chloranyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-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)NCC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H23ClN2O5S/c22-18-6-5-16(30(26,27)24-8-2-1-3-9-24)13-17(18)21(25)23-14-15-4-7-19-20(12-15)29-11-10-28-19/h4-7,12-13H,1-3,8-11,14H2,(H,23,25)