5-morpholin-4-ylsulfonyl-N-(pyridin-3-ylmethyl)pyridin-1-ium-2-amine

Systemtic Name: 5-morpholin-4-ylsulfonyl-N-(pyridin-3-ylmethyl)pyridin-1-ium-2-amine Openeye Name: 5-morpholinosulfonyl-N-(3-pyridylmethyl)pyridin-1-ium-2-amine CAS Name: 5-(4-morpholinylsulfonyl)-N-(3-pyridinylmethyl)-2-pyridin-1-iumamine IUPAC Name: 5-morpholin-4-ylsulfonyl-N-(pyridin-3-ylmethyl)pyridin-1-ium-2-amine Traditional Name: (5-morpholinosulfonylpyridin-1-ium-2-yl)-(3-pyridylmethyl)amine Formula: C15H19N4O3S+ MolecularWeight: 335.40136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C[NH+]=C(C=C2)NCC3=CN=CC=C3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C[NH+]=C(C=C2)NCC3=CN=CC=C3

InChI

InChI=1S/C15H18N4O3S/c20-23(21,19-6-8-22-9-7-19)14-3-4-15(18-12-14)17-11-13-2-1-5-16-10-13/h1-5,10,12H,6-9,11H2,(H,17,18)/p+1