Molecule ID: 50986167

IUPAC Name: 5-methylphenazin-5-ium-1-carboxylate

Description: The molecule is an iminium betaine consisting of phenazine carrying carboxylate- and methyl substituents at positions 1 and 5 respectively. It is a phenazine and an iminium betaine.

SMILES: C[n+]1c2ccccc2nc2c(C(=O)[O-])cccc21

SELFIES: [C][N+1][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O-1][C][=C][C][=C][Ring1][=Branch2][Ring1][P]

InChI: InChI=1S/C14H10N2O2/c1-16-11-7-3-2-6-10(11)15-13-9(14(17)18)5-4-8-12(13)16/h2-8H,1H3

Molecular Properties:
- Polar Surface Area: 56.9 Ų
- LogP: 2.9