4-[(4-methyl-3-nitro-phenyl)amino]butanoic acid

Systemtic Name: 4-[(4-methyl-3-nitro-phenyl)amino]butanoic acid Openeye Name: 4-(4-methyl-3-nitro-anilino)butanoic acid CAS Name: 4-(4-methyl-3-nitroanilino)butanoic acid IUPAC Name: 4-(4-methyl-3-nitroanilino)butanoic acid Traditional Name: 4-(4-methyl-3-nitro-anilino)butyric acid Formula: C11H14N2O4 MolecularWeight: 238.23986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O4/c1-8-4-5-9(7-10(8)13(16)17)12-6-2-3-11(14)15/h4-5,7,12H,2-3,6H2,1H3,(H,14,15)