N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-4-oxo-butanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-4-oxobutanamide Traditional Name: 4-[4-(4-chlorophenyl)sulfonylpiperazino]-4-keto-N-piperonyl-butyramide Formula: C22H24ClN3O6S MolecularWeight: 493.96046

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H24ClN3O6S/c23-17-2-4-18(5-3-17)33(29,30)26-11-9-25(10-12-26)22(28)8-7-21(27)24-14-16-1-6-19-20(13-16)32-15-31-19/h1-6,13H,7-12,14-15H2,(H,24,27)