2-[4-[(4-cyanophenyl)diazenyl]-2,3,5,6-tetradeuterio-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(4-cyanophenyl)diazenyl]-2,3,5,6-tetradeuterio-phenoxy]ethanoic acid Openeye Name: 2-[4-(4-cyanophenyl)azo-2,3,5,6-tetradeuterio-phenoxy]acetic acid CAS Name: 2-[4-(4-cyanophenyl)azo-2,3,5,6-tetradeuteriophenoxy]acetic acid IUPAC Name: 2-[4-[(4-cyanophenyl)diazenyl]-2,3,5,6-tetradeuteriophenoxy]acetic acid Traditional Name: 2-[4-(4-cyanophenyl)azo-2,3,5,6-tetradeuterio-phenoxy]acetic acid Formula: C15H11N3O3 MolecularWeight: 285.290787

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)N=NC2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1N=NC2=CC=C(C=C2)C#N)[2H])[2H])OCC(=O)O)[2H]

InChI

InChI=1S/C15H11N3O3/c16-9-11-1-3-12(4-2-11)17-18-13-5-7-14(8-6-13)21-10-15(19)20/h1-8H,10H2,(H,19,20)/i5D,6D,7D,8D