1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(3-nitropyridin-2-yl)piperazine

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(3-nitropyridin-2-yl)piperazine Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(3-nitro-2-pyridyl)piperazine CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(3-nitro-2-pyridinyl)piperazine IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(3-nitropyridin-2-yl)piperazine Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(3-nitro-2-pyridyl)piperazine Formula: C17H18N4O6S MolecularWeight: 406.41302

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)[N+](=O)[O-])S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)[N+](=O)[O-])S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C17H18N4O6S/c22-21(23)14-2-1-5-18-17(14)19-6-8-20(9-7-19)28(24,25)13-3-4-15-16(12-13)27-11-10-26-15/h1-5,12H,6-11H2