2,2,6,6-tetramethyl-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperidin-1-ium-4-amine

Systemtic Name: 2,2,6,6-tetramethyl-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperidin-1-ium-4-amine Openeye Name: 2,2,6,6-tetramethyl-N-(4-morpholinosulfonyl-2-nitro-phenyl)piperidin-1-ium-4-amine CAS Name: 2,2,6,6-tetramethyl-N-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-4-piperidin-1-iumamine IUPAC Name: 2,2,6,6-tetramethyl-N-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperidin-1-ium-4-amine Traditional Name: (4-morpholinosulfonyl-2-nitro-phenyl)-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amine Formula: C19H31N4O5S+ MolecularWeight: 427.53824

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])C

InChI

InChI=1S/C19H30N4O5S/c1-18(2)12-14(13-19(3,4)21-18)20-16-6-5-15(11-17(16)23(24)25)29(26,27)22-7-9-28-10-8-22/h5-6,11,14,20-21H,7-10,12-13H2,1-4H3/p+1