N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(1-piperidylsulfonyl)benzamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-piperidinosulfonyl-benzamide Formula: C20H21BrN2O5S MolecularWeight: 481.36014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)NC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)NC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C20H21BrN2O5S/c21-15-12-17-18(28-11-10-27-17)13-16(15)22-20(24)14-6-2-3-7-19(14)29(25,26)23-8-4-1-5-9-23/h2-3,6-7,12-13H,1,4-5,8-11H2,(H,22,24)