N-[[3-methyl-7-(2-piperidin-1-ium-1-ylethanoyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[[3-methyl-7-(2-piperidin-1-ium-1-ylethanoyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-1-phenyl-methanesulfonamide Openeye Name: N-[[3-methyl-7-(2-piperidin-1-ium-1-ylacetyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-1-phenyl-methanesulfonamide CAS Name: N-[[3-methyl-7-[1-oxo-2-(1-piperidin-1-iumyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-1-phenylmethanesulfonamide IUPAC Name: N-[[3-methyl-7-(2-piperidin-1-ium-1-ylacetyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-1-phenylmethanesulfonamide Traditional Name: N-[[3-methyl-7-(2-piperidin-1-ium-1-ylacetyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-1-phenyl-methanesulfonamide Formula: C24H33N4O3S+ MolecularWeight: 457.60882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2CN(CCC2=C1CNS(=O)(=O)CC3=CC=CC=C3)C(=O)C[NH+]4CCCCC4

Isomeric SMILES

CC1=NC=C2CN(CCC2=C1CNS(=O)(=O)CC3=CC=CC=C3)C(=O)C[NH+]4CCCCC4

InChI

InChI=1S/C24H32N4O3S/c1-19-23(15-26-32(30,31)18-20-8-4-2-5-9-20)22-10-13-28(16-21(22)14-25-19)24(29)17-27-11-6-3-7-12-27/h2,4-5,8-9,14,26H,3,6-7,10-13,15-18H2,1H3/p+1