azane; 2-[(2,4,6-trimethylphenyl)methylidene]propanedioic acid

Systemtic Name: azane; 2-[(2,4,6-trimethylphenyl)methylidene]propanedioic acid Openeye Name: ammonia; 2-[(2,4,6-trimethylphenyl)methylene]propanedioic acid CAS Name: ammonia; 2-[(2,4,6-trimethylphenyl)methylidene]propanedioic acid IUPAC Name: azane; 2-[(2,4,6-trimethylphenyl)methylidene]propanedioic acid Traditional Name: ammonia; 2-(2,4,6-trimethylbenzylidene)malonic acid Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C=C(C(=O)O)C(=O)O)C.N.N

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C=C(C(=O)O)C(=O)O)C.N.N

InChI

InChI=1S/C13H14O4.2H3N/c1-7-4-8(2)10(9(3)5-7)6-11(12(14)15)13(16)17;;/h4-6H,1-3H3,(H,14,15)(H,16,17);2*1H3