[(E)-[1-(2-carboxyethyl)pyridin-2-ylidene]methyl]-oxidanylidene-azanium bromide

Systemtic Name: [(E)-[1-(2-carboxyethyl)pyridin-2-ylidene]methyl]-oxidanylidene-azanium bromide Openeye Name: [(E)-[1-(2-carboxyethyl)-2-pyridylidene]methyl]-oxo-ammonium bromide CAS Name: [(E)-[1-(2-carboxyethyl)-2-pyridinylidene]methyl]-oxoammonium bromide IUPAC Name: [(E)-[1-(2-carboxyethyl)pyridin-2-ylidene]methyl]-oxoazanium bromide Traditional Name: [(E)-[1-(2-carboxyethyl)-2-pyridylidene]methyl]-keto-ammonium bromide Formula: C9H11BrN2O3 MolecularWeight: 275.09924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[NH+]=O)N(C=C1)CCC(=O)O.[Br-]

Isomeric SMILES

C1=C/C(=C\[NH+]=O)/N(C=C1)CCC(=O)O.[Br-]

InChI

InChI=1S/C9H10N2O3.BrH/c12-9(13)4-6-11-5-2-1-3-8(11)7-10-14;/h1-3,5,7H,4,6H2,(H,12,13);1H/b8-7+;