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

Systemtic Name: 3-[[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]amino]propanoic acid Openeye Name: 3-[[2-(2,5-dimethylanilino)-2-oxo-ethyl]amino]propanoic acid CAS Name: 3-[[2-(2,5-dimethylanilino)-2-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-(2,5-dimethylanilino)-2-oxoethyl]amino]propanoic acid Traditional Name: 3-[[2-(2,5-dimethylanilino)-2-keto-ethyl]amino]propionic acid Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CNCCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CNCCC(=O)O

InChI

InChI=1S/C13H18N2O3/c1-9-3-4-10(2)11(7-9)15-12(16)8-14-6-5-13(17)18/h3-4,7,14H,5-6,8H2,1-2H3,(H,15,16)(H,17,18)