N'-methyl-N-(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)-N'-phenyl-propane-1,3-diamine

Systemtic Name: N'-methyl-N-(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)-N'-phenyl-propane-1,3-diamine Openeye Name: N'-methyl-N-(5-morpholinosulfonylpyridin-1-ium-2-yl)-N'-phenyl-propane-1,3-diamine CAS Name: N'-methyl-N-[5-(4-morpholinylsulfonyl)-2-pyridin-1-iumyl]-N'-phenylpropane-1,3-diamine IUPAC Name: N'-methyl-N-(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)-N'-phenylpropane-1,3-diamine Traditional Name: methyl-[3-[(5-morpholinosulfonylpyridin-1-ium-2-yl)amino]propyl]-phenyl-amine Formula: C19H27N4O3S+ MolecularWeight: 391.50768

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC1=[NH+]C=C(C=C1)S(=O)(=O)N2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

CN(CCCNC1=[NH+]C=C(C=C1)S(=O)(=O)N2CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C19H26N4O3S/c1-22(17-6-3-2-4-7-17)11-5-10-20-19-9-8-18(16-21-19)27(24,25)23-12-14-26-15-13-23/h2-4,6-9,16H,5,10-15H2,1H3,(H,20,21)/p+1