3-cyclopentyl-1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-cyclopentyl-1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]propan-1-one Openeye Name: 3-cyclopentyl-1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]propan-1-one CAS Name: 3-cyclopentyl-1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-cyclopentyl-1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]propan-1-one Traditional Name: 3-cyclopentyl-1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazino]propan-1-one Formula: C20H28N2O5S MolecularWeight: 408.51172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCC(C1)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H28N2O5S/c23-20(8-5-16-3-1-2-4-16)21-9-11-22(12-10-21)28(24,25)17-6-7-18-19(15-17)27-14-13-26-18/h6-7,15-16H,1-5,8-14H2