N-[3-[4-(3-methoxypyridin-2-yl)piperazin-1-yl]-3-oxidanylidene-propyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[3-[4-(3-methoxypyridin-2-yl)piperazin-1-yl]-3-oxidanylidene-propyl]-2-nitro-benzenesulfonamide Openeye Name: N-[3-[4-(3-methoxy-2-pyridyl)piperazin-1-yl]-3-oxo-propyl]-2-nitro-benzenesulfonamide CAS Name: N-[3-[4-(3-methoxy-2-pyridinyl)-1-piperazinyl]-3-oxopropyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[3-[4-(3-methoxypyridin-2-yl)piperazin-1-yl]-3-oxopropyl]-2-nitrobenzenesulfonamide Traditional Name: N-[3-keto-3-[4-(3-methoxy-2-pyridyl)piperazino]propyl]-2-nitro-benzenesulfonamide Formula: C19H23N5O6S MolecularWeight: 449.48082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=CC=C1)N2CCN(CC2)C(=O)CCNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=C(N=CC=C1)N2CCN(CC2)C(=O)CCNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H23N5O6S/c1-30-16-6-4-9-20-19(16)23-13-11-22(12-14-23)18(25)8-10-21-31(28,29)17-7-3-2-5-15(17)24(26)27/h2-7,9,21H,8,10-14H2,1H3