(E)-4-[(2-iodanylphenyl)-methyl-amino]-3-methyl-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(2-iodanylphenyl)-methyl-amino]-3-methyl-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(2-iodo-N-methyl-anilino)-3-methyl-4-oxo-but-2-enoic acid CAS Name: (E)-4-(2-iodo-N-methylanilino)-3-methyl-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(2-iodo-N-methylanilino)-3-methyl-4-oxobut-2-enoic acid Traditional Name: (E)-4-(2-iodo-N-methyl-anilino)-4-keto-3-methyl-but-2-enoic acid Formula: C12H12INO3 MolecularWeight: 345.13305

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)O)C(=O)N(C)C1=CC=CC=C1I

Isomeric SMILES

C/C(=C\C(=O)O)/C(=O)N(C)C1=CC=CC=C1I

InChI

InChI=1S/C12H12INO3/c1-8(7-11(15)16)12(17)14(2)10-6-4-3-5-9(10)13/h3-7H,1-2H3,(H,15,16)/b8-7+