4-oxidanidyl-3-(4-propoxyphenyl)-6,7-dihydro-5H-cyclopenta[b]pyrazin-1-ium 1-oxide

Systemtic Name: 4-oxidanidyl-3-(4-propoxyphenyl)-6,7-dihydro-5H-cyclopenta[b]pyrazin-1-ium 1-oxide Openeye Name: 4-oxido-3-(4-propoxyphenyl)-6,7-dihydro-5H-cyclopenta[b]pyrazin-1-ium 1-oxide CAS Name: 4-oxido-3-(4-propoxyphenyl)-6,7-dihydro-5H-cyclopenta[b]pyrazin-1-ium 1-oxide IUPAC Name: 4-oxido-3-(4-propoxyphenyl)-6,7-dihydro-5H-cyclopenta[b]pyrazin-1-ium 1-oxide Traditional Name: 4-oxido-3-(4-propoxyphenyl)-6,7-dihydro-5H-cyclopenta[b]pyrazin-1-ium 1-oxide Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=C[N+](=O)C3=C(N2[O-])CCC3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=C[N+](=O)C3=C(N2[O-])CCC3

InChI

InChI=1S/C16H18N2O3/c1-2-10-21-13-8-6-12(7-9-13)16-11-17(19)14-4-3-5-15(14)18(16)20/h6-9,11H,2-5,10H2,1H3