4-[(1R)-2-ethoxy-1-[(4-nitrophenyl)diazenyl]-2-oxidanylidene-ethyl]sulfanylbutanoate

Systemtic Name: 4-[(1R)-2-ethoxy-1-[(4-nitrophenyl)diazenyl]-2-oxidanylidene-ethyl]sulfanylbutanoate Openeye Name: 4-[(1R)-2-ethoxy-1-(4-nitrophenyl)azo-2-oxo-ethyl]sulfanylbutanoate CAS Name: 4-[[(1R)-2-ethoxy-1-(4-nitrophenyl)azo-2-oxoethyl]thio]butanoate IUPAC Name: 4-[(1R)-2-ethoxy-1-[(4-nitrophenyl)diazenyl]-2-oxoethyl]sulfanylbutanoate Traditional Name: 4-[[(1R)-2-ethoxy-2-keto-1-(4-nitrophenyl)azo-ethyl]thio]butyrate Formula: C14H16N3O6S- MolecularWeight: 354.35834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(N=NC1=CC=C(C=C1)[N+](=O)[O-])SCCCC(=O)[O-]

Isomeric SMILES

CCOC(=O)[C@H](N=NC1=CC=C(C=C1)[N+](=O)[O-])SCCCC(=O)[O-]

InChI

InChI=1S/C14H17N3O6S/c1-2-23-14(20)13(24-9-3-4-12(18)19)16-15-10-5-7-11(8-6-10)17(21)22/h5-8,13H,2-4,9H2,1H3,(H,18,19)/p-1/t13-/m1/s1