1-oxidanidyl-3-(3-oxidanidylpyrimidin-3-ium-4-yl)-1,4,4a,8a-tetrahydroquinolin-1-ium

Systemtic Name: 1-oxidanidyl-3-(3-oxidanidylpyrimidin-3-ium-4-yl)-1,4,4a,8a-tetrahydroquinolin-1-ium Openeye Name: 1-oxido-3-(3-oxidopyrimidin-3-ium-4-yl)-1,4,4a,8a-tetrahydroquinolin-1-ium CAS Name: 1-oxido-3-(3-oxido-4-pyrimidin-3-iumyl)-1,4,4a,8a-tetrahydroquinolin-1-ium IUPAC Name: 1-oxido-3-(3-oxidopyrimidin-3-ium-4-yl)-1,4,4a,8a-tetrahydroquinolin-1-ium Traditional Name: 1-oxido-3-(3-oxidopyrimidin-3-ium-4-yl)-1,4,4a,8a-tetrahydroquinolin-1-ium Formula: C13H13N3O2 MolecularWeight: 243.26122

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C=CC=CC2[NH+](C=C1C3=[N+](C=NC=C3)[O-])[O-]

Isomeric SMILES

C1C2C=CC=CC2[NH+](C=C1C3=[N+](C=NC=C3)[O-])[O-]

InChI

InChI=1S/C13H13N3O2/c17-15-8-11(13-5-6-14-9-16(13)18)7-10-3-1-2-4-12(10)15/h1-6,8-10,12,15H,7H2