2-oxidanyl-3-piperidin-1-ium-1-yl-1-(thiophen-2-ylmethyl)-1,8-naphthyridin-4-one hydroxide

Systemtic Name: 2-oxidanyl-3-piperidin-1-ium-1-yl-1-(thiophen-2-ylmethyl)-1,8-naphthyridin-4-one hydroxide Openeye Name: 2-hydroxy-3-piperidin-1-ium-1-yl-1-(2-thienylmethyl)-1,8-naphthyridin-4-one hydroxide CAS Name: 2-hydroxy-3-(1-piperidin-1-iumyl)-1-(thiophen-2-ylmethyl)-1,8-naphthyridin-4-one hydroxide IUPAC Name: 2-hydroxy-3-piperidin-1-ium-1-yl-1-(thiophen-2-ylmethyl)-1,8-naphthyridin-4-one hydroxide Traditional Name: 2-hydroxy-3-piperidin-1-ium-1-yl-1-(2-thenyl)-1,8-naphthyridin-4-one hydroxide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2=C(N(C3=C(C2=O)C=CC=N3)CC4=CC=CS4)O.[OH-]

Isomeric SMILES

C1CC[NH+](CC1)C2=C(N(C3=C(C2=O)C=CC=N3)CC4=CC=CS4)O.[OH-]

InChI

InChI=1S/C18H19N3O2S.H2O/c22-16-14-7-4-8-19-17(14)21(12-13-6-5-11-24-13)18(23)15(16)20-9-2-1-3-10-20;/h4-8,11,23H,1-3,9-10,12H2;1H2