3,5-bis(azanyl)-3-chloranyl-cyclohexa-1,4-diene-1-carboxylic acid

Systemtic Name: 3,5-bis(azanyl)-3-chloranyl-cyclohexa-1,4-diene-1-carboxylic acid Openeye Name: 3,5-diamino-3-chloro-cyclohexa-1,4-diene-1-carboxylic acid CAS Name: 3,5-diamino-3-chloro-1-cyclohexa-1,4-dienecarboxylic acid IUPAC Name: 3,5-diamino-3-chlorocyclohexa-1,4-diene-1-carboxylic acid Traditional Name: 3,5-diamino-3-chloro-cyclohexa-1,4-diene-1-carboxylic acid Formula: C7H9ClN2O2 MolecularWeight: 188.61156

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC(C=C1N)(N)Cl)C(=O)O

Isomeric SMILES

C1C(=CC(C=C1N)(N)Cl)C(=O)O

InChI

InChI=1S/C7H9ClN2O2/c8-7(10)2-4(6(11)12)1-5(9)3-7/h2-3H,1,9-10H2,(H,11,12)