2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(3-nitrophenyl)sulfonylpiperazino]ethanone Formula: C20H20ClN3O7S MolecularWeight: 481.9067

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC3=C(C(=C2)Cl)OCCO3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC3=C(C(=C2)Cl)OCCO3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN3O7S/c21-17-10-14(11-18-20(17)31-9-8-30-18)12-19(25)22-4-6-23(7-5-22)32(28,29)16-3-1-2-15(13-16)24(26)27/h1-3,10-11,13H,4-9,12H2