Molecule ID: 54726365

IUPAC Name: 2-carboxy-4-nitrophenolate

Description: The molecule is a monohydroxybenzoate that is obtained by removal of a proton from the carboxylic acid group of 5-nitrosalicylic acid. It is a salicylate and a monohydroxybenzoate. It is a conjugate base of a 5-nitrosalicylic acid.

SMILES: O=C(O)c1cc([N+](=O)[O-])ccc1[O-]

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

InChI: InChI=1S/C7H5NO5/c9-6-2-1-4(8(12)13)3-5(6)7(10)11/h1-3,9H,(H,10,11)/p-1

Molecular Properties:
- Polar Surface Area: 106.0 Ų
- LogP: 2.2