diethyl-[(1S)-2-[(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)amino]-1-phenyl-ethyl]azanium

Systemtic Name: diethyl-[(1S)-2-[(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)amino]-1-phenyl-ethyl]azanium Openeye Name: diethyl-[(1S)-2-[(5-morpholinosulfonylpyridin-1-ium-2-yl)amino]-1-phenyl-ethyl]ammonium CAS Name: diethyl-[(1S)-2-[[5-(4-morpholinylsulfonyl)-2-pyridin-1-iumyl]amino]-1-phenylethyl]ammonium IUPAC Name: diethyl-[(1S)-2-[(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)amino]-1-phenylethyl]azanium Traditional Name: diethyl-[(1S)-2-[(5-morpholinosulfonylpyridin-1-ium-2-yl)amino]-1-phenyl-ethyl]ammonium Formula: C21H32N4O3S+2 MolecularWeight: 420.56878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N4O3S/c1-3-24(4-2)20(18-8-6-5-7-9-18)17-23-21-11-10-19(16-22-21)29(26,27)25-12-14-28-15-13-25/h5-11,16,20H,3-4,12-15,17H2,1-2H3,(H,22,23)/p+2/t20-/m1/s1