(2Z)-2-[(4-dimethylaminophenyl)methylidene]imidazol-1-ium-1-amine; hydrogen carbonate

Systemtic Name: (2Z)-2-[(4-dimethylaminophenyl)methylidene]imidazol-1-ium-1-amine; hydrogen carbonate Openeye Name: (2Z)-2-[(4-dimethylaminophenyl)methylene]imidazol-1-ium-1-amine; hydrogen carbonate CAS Name: (2Z)-2-[(4-dimethylaminophenyl)methylidene]-1-imidazol-1-iumamine; hydrogen carbonate IUPAC Name: (2Z)-2-[(4-dimethylaminophenyl)methylidene]imidazol-1-ium-1-amine; hydrogen carbonate Traditional Name: [4-[(Z)-(1-aminoimidazol-1-ium-2-ylidene)methyl]phenyl]-dimethyl-amine bicarbonate Formula: C13H16N4O3 MolecularWeight: 276.29114

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=C2N=CC=[N+]2N.C(=O)(O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C\2/N=CC=[N+]2N.C(=O)(O)[O-]

InChI

InChI=1S/C12H15N4.CH2O3/c1-15(2)11-5-3-10(4-6-11)9-12-14-7-8-16(12)13;2-1(3)4/h3-9H,13H2,1-2H3;(H2,2,3,4)/q+1;/p-1