N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]benzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide Formula: C20H24N3O5S+ MolecularWeight: 418.48666

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H23N3O5S/c1-22-8-10-23(11-9-22)29(25,26)17-5-2-15(3-6-17)20(24)21-16-4-7-18-19(14-16)28-13-12-27-18/h2-7,14H,8-13H2,1H3,(H,21,24)/p+1