N-methyl-4-(3-nitrophenyl)sulfonyl-N-pentyl-morpholin-4-ium-4-amine

Systemtic Name: N-methyl-4-(3-nitrophenyl)sulfonyl-N-pentyl-morpholin-4-ium-4-amine Openeye Name: N-methyl-4-(3-nitrophenyl)sulfonyl-N-pentyl-morpholin-4-ium-4-amine CAS Name: N-methyl-4-(3-nitrophenyl)sulfonyl-N-pentyl-4-morpholin-4-iumamine IUPAC Name: N-methyl-4-(3-nitrophenyl)sulfonyl-N-pentylmorpholin-4-ium-4-amine Traditional Name: amyl-methyl-[4-(3-nitrophenyl)sulfonylmorpholin-4-ium-4-yl]amine Formula: C16H26N3O5S+ MolecularWeight: 372.45974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C)[N+]1(CCOCC1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(C)[N+]1(CCOCC1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H26N3O5S/c1-3-4-5-9-17(2)19(10-12-24-13-11-19)25(22,23)16-8-6-7-15(14-16)18(20)21/h6-8,14H,3-5,9-13H2,1-2H3/q+1