N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[4-chloro-3-(1-piperidylsulfonyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-(4-chloro-3-piperidin-1-ylsulfonylphenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-(4-chloro-3-piperidinosulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C20H21ClN2O5S MolecularWeight: 436.90914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN2O5S/c21-16-6-5-15(13-19(16)29(25,26)23-8-2-1-3-9-23)22-20(24)14-4-7-17-18(12-14)28-11-10-27-17/h4-7,12-13H,1-3,8-11H2,(H,22,24)