2-chloranyl-3-(4-methyl-2-nitro-phenyl)propanoic acid

Systemtic Name: 2-chloranyl-3-(4-methyl-2-nitro-phenyl)propanoic acid Openeye Name: 2-chloro-3-(4-methyl-2-nitro-phenyl)propanoic acid CAS Name: 2-chloro-3-(4-methyl-2-nitrophenyl)propanoic acid IUPAC Name: 2-chloro-3-(4-methyl-2-nitrophenyl)propanoic acid Traditional Name: 2-chloro-3-(4-methyl-2-nitro-phenyl)propionic acid Formula: C10H10ClNO4 MolecularWeight: 243.6437

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClNO4/c1-6-2-3-7(5-8(11)10(13)14)9(4-6)12(15)16/h2-4,8H,5H2,1H3,(H,13,14)