4-oxidanylidene-4-[(2,3,4,5,6-pentadeuteriophenyl)amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[(2,3,4,5,6-pentadeuteriophenyl)amino]butanoic acid Openeye Name: 4-oxo-4-(2,3,4,5,6-pentadeuterioanilino)butanoic acid CAS Name: 4-oxo-4-(2,3,4,5,6-pentadeuterioanilino)butanoic acid IUPAC Name: 4-oxo-4-(2,3,4,5,6-pentadeuterioanilino)butanoic acid Traditional Name: 4-keto-4-(2,3,4,5,6-pentadeuterioanilino)butyric acid Formula: C10H11NO3 MolecularWeight: 198.230049

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCC(=O)O

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1[2H])[2H])NC(=O)CCC(=O)O)[2H])[2H]

InChI

InChI=1S/C10H11NO3/c12-9(6-7-10(13)14)11-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)/i1D,2D,3D,4D,5D