[3-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]quinoxalin-2-yl]-(phenylsulfonyl)azanide

Systemtic Name: [3-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]quinoxalin-2-yl]-(phenylsulfonyl)azanide Openeye Name: benzenesulfonyl-[3-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-4-ium-1-yl]quinoxalin-2-yl]azanide CAS Name: benzenesulfonyl-[3-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazin-4-iumyl]-2-quinoxalinyl]azanide IUPAC Name: benzenesulfonyl-[3-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-4-ium-1-yl]quinoxalin-2-yl]azanide Traditional Name: besyl-[3-[4-(2-keto-2-piperidino-ethyl)piperazin-4-ium-1-yl]quinoxalin-2-yl]azanide Formula: C25H30N6O3S MolecularWeight: 494.6091

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C3=NC4=CC=CC=C4N=C3[N-]S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C3=NC4=CC=CC=C4N=C3[N-]S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H29N6O3S/c32-23(30-13-7-2-8-14-30)19-29-15-17-31(18-16-29)25-24(26-21-11-5-6-12-22(21)27-25)28-35(33,34)20-9-3-1-4-10-20/h1,3-6,9-12H,2,7-8,13-19H2/q-1/p+1