N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-4-ethanoyl-benzenesulfonamide

Systemtic Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-4-ethanoyl-benzenesulfonamide Openeye Name: 4-acetyl-N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-oxo-butyl]benzenesulfonamide CAS Name: 4-acetyl-N-[4-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-4-oxobutyl]benzenesulfonamide IUPAC Name: 4-acetyl-N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-oxobutyl]benzenesulfonamide Traditional Name: 4-acetyl-N-[4-keto-4-(4-piperonylpiperazino)butyl]benzenesulfonamide Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCCC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCCC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H29N3O6S/c1-18(28)20-5-7-21(8-6-20)34(30,31)25-10-2-3-24(29)27-13-11-26(12-14-27)16-19-4-9-22-23(15-19)33-17-32-22/h4-9,15,25H,2-3,10-14,16-17H2,1H3