4-[(1-ethylpiperidin-1-ium-4-yl)amino]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(1-ethylpiperidin-1-ium-4-yl)amino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[(1-ethylpiperidin-1-ium-4-yl)amino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[(1-ethyl-4-piperidin-1-iumyl)amino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[(1-ethylpiperidin-1-ium-4-yl)amino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(1-ethylpiperidin-1-ium-4-yl)amino]-N-methyl-3-nitro-benzenesulfonamide Formula: C14H23N4O4S+ MolecularWeight: 343.42182

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC2=C(C=C(C=C2)S(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCC(CC1)NC2=C(C=C(C=C2)S(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C14H22N4O4S/c1-3-17-8-6-11(7-9-17)16-13-5-4-12(23(21,22)15-2)10-14(13)18(19)20/h4-5,10-11,15-16H,3,6-9H2,1-2H3/p+1