3,5-dimethyl-4-oxidanidyl-2-phenyl-6-(4-propoxyphenyl)pyrazin-1-ium 1-oxide

Systemtic Name: 3,5-dimethyl-4-oxidanidyl-2-phenyl-6-(4-propoxyphenyl)pyrazin-1-ium 1-oxide Openeye Name: 3,5-dimethyl-4-oxido-2-phenyl-6-(4-propoxyphenyl)pyrazin-1-ium 1-oxide CAS Name: 3,5-dimethyl-4-oxido-2-phenyl-6-(4-propoxyphenyl)pyrazin-1-ium 1-oxide IUPAC Name: 3,5-dimethyl-4-oxido-2-phenyl-6-(4-propoxyphenyl)pyrazin-1-ium 1-oxide Traditional Name: 3,5-dimethyl-4-oxido-2-phenyl-6-(4-propoxyphenyl)pyrazin-1-ium 1-oxide Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=C(N(C(=C([N+]2=O)C3=CC=CC=C3)C)[O-])C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=C(N(C(=C([N+]2=O)C3=CC=CC=C3)C)[O-])C

InChI

InChI=1S/C21H22N2O3/c1-4-14-26-19-12-10-18(11-13-19)21-16(3)22(24)15(2)20(23(21)25)17-8-6-5-7-9-17/h5-13H,4,14H2,1-3H3