Molecule ID: 119058162

IUPAC Name: (1R)-1,4,5,10-tetrahydrophenazine-1-carboxylic acid

Description: The molecule is a member of the class of phenazines that is 1,4,5,10-tetrahydrophenazine substituted at position 1 by a carboxy group (the R-enantiomer). It is a member of phenazines and an aromatic amino acid. It is a conjugate acid of a (1R)-1,4,5,10-tetrahydrophenazine-1-carboxylate.

SMILES: O=C(O)[C@@H]1C=CCC2=C1Nc1ccccc1N2

SELFIES: [O][=C][Branch1][C][O][C@@H1][C][=C][C][C][=C][Ring1][=Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][#Branch2]

InChI: InChI=1S/C13H12N2O2/c16-13(17)8-4-3-7-11-12(8)15-10-6-2-1-5-9(10)14-11/h1-6,8,14-15H,7H2,(H,16,17)/t8-/m1/s1

Molecular Properties:
- Polar Surface Area: 61.4 Ų
- LogP: 2.0