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

Systemtic Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-N-phenyl-methanesulfonamide Openeye Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-oxo-butyl]-N-phenyl-methanesulfonamide CAS Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-4-oxobutyl]-N-phenylmethanesulfonamide IUPAC Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-oxobutyl]-N-phenylmethanesulfonamide Traditional Name: N-[4-keto-4-(4-piperonylpiperazino)butyl]-N-phenyl-methanesulfonamide Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C23H29N3O5S/c1-32(28,29)26(20-6-3-2-4-7-20)11-5-8-23(27)25-14-12-24(13-15-25)17-19-9-10-21-22(16-19)31-18-30-21/h2-4,6-7,9-10,16H,5,8,11-15,17-18H2,1H3