5-[1,2,3,4-tetrakis(oxidanyl)butyl]-1H-1,7-naphthyridin-1-ium-4-one

Systemtic Name: 5-[1,2,3,4-tetrakis(oxidanyl)butyl]-1H-1,7-naphthyridin-1-ium-4-one Openeye Name: 5-(1,2,3,4-tetrahydroxybutyl)-1H-1,7-naphthyridin-1-ium-4-one CAS Name: 5-(1,2,3,4-tetrahydroxybutyl)-1H-1,7-naphthyridin-1-ium-4-one IUPAC Name: 5-(1,2,3,4-tetrahydroxybutyl)-1H-1,7-naphthyridin-1-ium-4-one Traditional Name: 5-(1,2,3,4-tetrahydroxybutyl)-1H-1,7-naphthyridin-1-ium-4-one Formula: C12H15N2O5+ MolecularWeight: 267.2579

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C[NH2+]C2=C(C1=O)C(=CN=C2)C(C(C(CO)O)O)O

Isomeric SMILES

C1=C[NH2+]C2=C(C1=O)C(=CN=C2)C(C(C(CO)O)O)O

InChI

InChI=1S/C12H14N2O5/c15-5-9(17)12(19)11(18)6-3-13-4-7-10(6)8(16)1-2-14-7/h1-4,9,11-12,15,17-19H,5H2,(H,14,16)/p+1