3-[(2,5-dimethylphenyl)-methanoyl-amino]propanoic acid

Systemtic Name: 3-[(2,5-dimethylphenyl)-methanoyl-amino]propanoic acid Openeye Name: 3-(N-formyl-2,5-dimethyl-anilino)propanoic acid CAS Name: 3-(N-formyl-2,5-dimethylanilino)propanoic acid IUPAC Name: 3-(N-formyl-2,5-dimethylanilino)propanoic acid Traditional Name: 3-(N-formyl-2,5-dimethyl-anilino)propionic acid Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CCC(=O)O)C=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CCC(=O)O)C=O

InChI

InChI=1S/C12H15NO3/c1-9-3-4-10(2)11(7-9)13(8-14)6-5-12(15)16/h3-4,7-8H,5-6H2,1-2H3,(H,15,16)