1-azanyl-3-bromanyl-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 1-azanyl-3-bromanyl-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 1-amino-3-bromo-cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 1-amino-3-bromo-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 1-amino-3-bromocyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 1-amino-3-bromo-cyclohexa-2,4-diene-1-carboxylic acid Formula: C7H8BrNO2 MolecularWeight: 218.04792

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=CC1(C(=O)O)N)Br

Isomeric SMILES

C1C=CC(=CC1(C(=O)O)N)Br

InChI

InChI=1S/C7H8BrNO2/c8-5-2-1-3-7(9,4-5)6(10)11/h1-2,4H,3,9H2,(H,10,11)