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

Systemtic Name: 3-[methanoyl-(3-methyl-4-nitro-phenyl)amino]propanoic acid Openeye Name: 3-(N-formyl-3-methyl-4-nitro-anilino)propanoic acid CAS Name: 3-(N-formyl-3-methyl-4-nitroanilino)propanoic acid IUPAC Name: 3-(N-formyl-3-methyl-4-nitroanilino)propanoic acid Traditional Name: 3-(N-formyl-3-methyl-4-nitro-anilino)propionic acid Formula: C11H12N2O5 MolecularWeight: 252.22338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O5/c1-8-6-9(2-3-10(8)13(17)18)12(7-14)5-4-11(15)16/h2-3,6-7H,4-5H2,1H3,(H,15,16)