[(1S)-1-(3-methoxyphenyl)-2-[(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)amino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(3-methoxyphenyl)-2-[(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)amino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(3-methoxyphenyl)-2-[(5-morpholinosulfonylpyridin-1-ium-2-yl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(3-methoxyphenyl)-2-[[5-(4-morpholinylsulfonyl)-2-pyridin-1-iumyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(3-methoxyphenyl)-2-[(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(3-methoxyphenyl)-2-[(5-morpholinosulfonylpyridin-1-ium-2-yl)amino]ethyl]-dimethyl-ammonium Formula: C20H30N4O4S+2 MolecularWeight: 422.5416

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC1=[NH+]C=C(C=C1)S(=O)(=O)N2CCOCC2)C3=CC(=CC=C3)OC

Isomeric SMILES

C[NH+](C)[C@H](CNC1=[NH+]C=C(C=C1)S(=O)(=O)N2CCOCC2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C20H28N4O4S/c1-23(2)19(16-5-4-6-17(13-16)27-3)15-22-20-8-7-18(14-21-20)29(25,26)24-9-11-28-12-10-24/h4-8,13-14,19H,9-12,15H2,1-3H3,(H,21,22)/p+2/t19-/m1/s1