benzene; N-(1,3-dioxol-4-yl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide

Systemtic Name: benzene; N-(1,3-dioxol-4-yl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide Openeye Name: benzene; N-(1,3-dioxol-4-yl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide CAS Name: benzene; N-(1,3-dioxol-4-yl)-4-methoxy-3-(1-piperazinyl)benzenesulfonamide IUPAC Name: benzene; N-(1,3-dioxol-4-yl)-4-methoxy-3-piperazin-1-ylbenzenesulfonamide Traditional Name: benzene; N-(1,3-dioxol-4-yl)-4-methoxy-3-piperazino-benzenesulfonamide Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=COCO2)N3CCNCC3.C1=CC=CC=C1

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=COCO2)N3CCNCC3.C1=CC=CC=C1

InChI

InChI=1S/C14H19N3O5S.C6H6/c1-20-13-3-2-11(8-12(13)17-6-4-15-5-7-17)23(18,19)16-14-9-21-10-22-14;1-2-4-6-5-3-1/h2-3,8-9,15-16H,4-7,10H2,1H3;1-6H