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

Systemtic Name: 3-(2-methyl-3-nitro-phenyl)propanoic acid Openeye Name: 3-(2-methyl-3-nitro-phenyl)propanoic acid CAS Name: 3-(2-methyl-3-nitrophenyl)propanoic acid IUPAC Name: 3-(2-methyl-3-nitrophenyl)propanoic acid Traditional Name: 3-(2-methyl-3-nitro-phenyl)propionic acid Formula: C10H11NO4 MolecularWeight: 209.19864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO4/c1-7-8(5-6-10(12)13)3-2-4-9(7)11(14)15/h2-4H,5-6H2,1H3,(H,12,13)