Molecule ID: 49852392

IUPAC Name: 6-azaniumyl-5-oxocyclohex-2-ene-1-carboxylate

Description: The molecule is an amino acid zwitterion, obtained by transfer of a proton from the carboxylic acid group to the amino group of 6-amino-5-oxocyclohex-2-ene-1-carboxylic acid zwitterion. It is a tautomer of a 6-amino-5-oxocyclohex-2-ene-1-carboxylic acid.

SMILES: NC1C(=O)CC=CC1C(=O)O

SELFIES: [N][C][C][=Branch1][C][=O][C][C][=C][C][Ring1][#Branch1][C][=Branch1][C][=O][O]

InChI: InChI=1S/C7H9NO3/c8-6-4(7(10)11)2-1-3-5(6)9/h1-2,4,6H,3,8H2,(H,10,11)

Molecular Properties:
- Polar Surface Area: 84.8 Ų
- LogP: -1.9