1,3-benzodioxol-5-yl-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-(3-nitrophenyl)sulfonylpiperazino]methanone Formula: C18H17N3O7S MolecularWeight: 419.40848

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O7S/c22-18(13-4-5-16-17(10-13)28-12-27-16)19-6-8-20(9-7-19)29(25,26)15-3-1-2-14(11-15)21(23)24/h1-5,10-11H,6-9,12H2