2-azanyl-4-[(3,4-dimethoxyphenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one

Systemtic Name: 2-azanyl-4-[(3,4-dimethoxyphenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one Openeye Name: 2-amino-4-[(3,4-dimethoxyphenyl)methylene]-3-methyl-1H-imidazol-3-ium-5-one CAS Name: 2-amino-4-[(3,4-dimethoxyphenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one IUPAC Name: 2-amino-4-[(3,4-dimethoxyphenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one Traditional Name: 2-amino-1-methyl-5-veratrylidene-2-imidazolin-1-ium-4-one Formula: C13H16N3O3+ MolecularWeight: 262.28444

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC(=O)C1=CC2=CC(=C(C=C2)OC)OC)N

Isomeric SMILES

C[N+]1=C(NC(=O)C1=CC2=CC(=C(C=C2)OC)OC)N

InChI

InChI=1S/C13H15N3O3/c1-16-9(12(17)15-13(16)14)6-8-4-5-10(18-2)11(7-8)19-3/h4-7H,1-3H3,(H2,14,15,17)/p+1