(E)-4-(2-chloranyl-5-nitro-phenyl)-3-methyl-but-3-enoic acid

Systemtic Name: (E)-4-(2-chloranyl-5-nitro-phenyl)-3-methyl-but-3-enoic acid Openeye Name: (E)-4-(2-chloro-5-nitro-phenyl)-3-methyl-but-3-enoic acid CAS Name: (E)-4-(2-chloro-5-nitrophenyl)-3-methyl-3-butenoic acid IUPAC Name: (E)-4-(2-chloro-5-nitrophenyl)-3-methylbut-3-enoic acid Traditional Name: (E)-4-(2-chloro-5-nitro-phenyl)-3-methyl-but-3-enoic acid Formula: C11H10ClNO4 MolecularWeight: 255.6544

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)O

Isomeric SMILES

C/C(=C\C1=C(C=CC(=C1)[N+](=O)[O-])Cl)/CC(=O)O

InChI

InChI=1S/C11H10ClNO4/c1-7(5-11(14)15)4-8-6-9(13(16)17)2-3-10(8)12/h2-4,6H,5H2,1H3,(H,14,15)/b7-4+