N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-5-chloranyl-2-methoxy-N-methyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-5-chloranyl-2-methoxy-N-methyl-benzenesulfonamide Openeye Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-5-chloro-2-methoxy-N-methyl-benzenesulfonamide CAS Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-oxoethyl]-5-chloro-2-methoxy-N-methylbenzenesulfonamide IUPAC Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]-5-chloro-2-methoxy-N-methylbenzenesulfonamide Traditional Name: 5-chloro-N-[2-keto-2-(4-piperonylpiperazino)ethyl]-2-methoxy-N-methyl-benzenesulfonamide Formula: C22H26ClN3O6S MolecularWeight: 495.97634

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CN(CC(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C22H26ClN3O6S/c1-24(33(28,29)21-12-17(23)4-6-19(21)30-2)14-22(27)26-9-7-25(8-10-26)13-16-3-5-18-20(11-16)32-15-31-18/h3-6,11-12H,7-10,13-15H2,1-2H3