3-(4-ethoxyphenyl)-2-methyl-1-oxidanidyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyrazin-4-ium 4-oxide

Systemtic Name: 3-(4-ethoxyphenyl)-2-methyl-1-oxidanidyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyrazin-4-ium 4-oxide Openeye Name: 3-(4-ethoxyphenyl)-2-methyl-1-oxido-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyrazin-4-ium 4-oxide CAS Name: 3-(4-ethoxyphenyl)-2-methyl-1-oxido-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyrazin-4-ium 4-oxide IUPAC Name: 3-(4-ethoxyphenyl)-2-methyl-1-oxido-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyrazin-4-ium 4-oxide Traditional Name: 2-methyl-1-oxido-3-p-phenetyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyrazin-4-ium 4-oxide Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(N(C3=C([N+]2=O)CCCCC3)[O-])C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(N(C3=C([N+]2=O)CCCCC3)[O-])C

InChI

InChI=1S/C18H22N2O3/c1-3-23-15-11-9-14(10-12-15)18-13(2)19(21)16-7-5-4-6-8-17(16)20(18)22/h9-12H,3-8H2,1-2H3