(E)-4-(2-methylbut-3-yn-2-ylamino)-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-(2-methylbut-3-yn-2-ylamino)-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(1,1-dimethylprop-2-ynylamino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(2-methylbut-3-yn-2-ylamino)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(2-methylbut-3-yn-2-ylamino)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(1,1-dimethylprop-2-ynylamino)-4-keto-but-2-enoic acid Formula: C9H11NO3 MolecularWeight: 181.18854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)NC(=O)C=CC(=O)O

Isomeric SMILES

CC(C)(C#C)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C9H11NO3/c1-4-9(2,3)10-7(11)5-6-8(12)13/h1,5-6H,2-3H3,(H,10,11)(H,12,13)/b6-5+