N-[2-[4-(phenylmethyl)piperazin-1-yl]sulfonylethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-1-yl]sulfonylethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)sulfonylethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[2-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)sulfonylethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[2-(4-benzylpiperazino)sulfonylethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C21H27N3O6S2 MolecularWeight: 481.58558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)CCNS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)CCNS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H27N3O6S2/c25-31(26,24-11-9-23(10-12-24)17-18-4-2-1-3-5-18)15-8-22-32(27,28)19-6-7-20-21(16-19)30-14-13-29-20/h1-7,16,22H,8-15,17H2