(Z)-3-[[4-(2-hydroxyethyl)-2-iodanyl-phenyl]amino]but-2-enoic acid

Systemtic Name: (Z)-3-[[4-(2-hydroxyethyl)-2-iodanyl-phenyl]amino]but-2-enoic acid Openeye Name: (Z)-3-[4-(2-hydroxyethyl)-2-iodo-anilino]but-2-enoic acid CAS Name: (Z)-3-[4-(2-hydroxyethyl)-2-iodoanilino]-2-butenoic acid IUPAC Name: (Z)-3-[4-(2-hydroxyethyl)-2-iodoanilino]but-2-enoic acid Traditional Name: (Z)-3-[4-(2-hydroxyethyl)-2-iodo-anilino]but-2-enoic acid Formula: C12H14INO3 MolecularWeight: 347.14893

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)O)NC1=C(C=C(C=C1)CCO)I

Isomeric SMILES

C/C(=C/C(=O)O)/NC1=C(C=C(C=C1)CCO)I

InChI

InChI=1S/C12H14INO3/c1-8(6-12(16)17)14-11-3-2-9(4-5-15)7-10(11)13/h2-3,6-7,14-15H,4-5H2,1H3,(H,16,17)/b8-6-