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

Systemtic Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-5-chloranyl-2-ethoxy-N-methyl-benzenesulfonamide Openeye Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-5-chloro-2-ethoxy-N-methyl-benzenesulfonamide CAS Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-oxoethyl]-5-chloro-2-ethoxy-N-methylbenzenesulfonamide IUPAC Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]-5-chloro-2-ethoxy-N-methylbenzenesulfonamide Traditional Name: 5-chloro-2-ethoxy-N-[2-keto-2-(4-piperonylpiperazino)ethyl]-N-methyl-benzenesulfonamide Formula: C23H28ClN3O6S MolecularWeight: 510.00292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N(C)CC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N(C)CC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H28ClN3O6S/c1-3-31-20-7-5-18(24)13-22(20)34(29,30)25(2)15-23(28)27-10-8-26(9-11-27)14-17-4-6-19-21(12-17)33-16-32-19/h4-7,12-13H,3,8-11,14-16H2,1-2H3