(3-bromophenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (3-bromophenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]methanone CAS Name: (3-bromophenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (3-bromophenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazino]methanone Formula: C19H19BrN2O5S MolecularWeight: 467.33356

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=CC=C2)Br)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=CC=C2)Br)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H19BrN2O5S/c20-15-3-1-2-14(12-15)19(23)21-6-8-22(9-7-21)28(24,25)16-4-5-17-18(13-16)27-11-10-26-17/h1-5,12-13H,6-11H2