ethyl 2-(1,3-dithiolan-2-ylidene)-2-[(4-nitrophenyl)diazenyl]ethanoate

Systemtic Name: ethyl 2-(1,3-dithiolan-2-ylidene)-2-[(4-nitrophenyl)diazenyl]ethanoate Openeye Name: ethyl 2-(1,3-dithiolan-2-ylidene)-2-(4-nitrophenyl)azo-acetate CAS Name: 2-(1,3-dithiolan-2-ylidene)-2-(4-nitrophenyl)azoacetic acid ethyl ester IUPAC Name: ethyl 2-(1,3-dithiolan-2-ylidene)-2-[(4-nitrophenyl)diazenyl]acetate Traditional Name: 2-(1,3-dithiolan-2-ylidene)-2-(4-nitrophenyl)azo-acetic acid ethyl ester Formula: C13H13N3O4S2 MolecularWeight: 339.39002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1SCCS1)N=NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(=C1SCCS1)N=NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O4S2/c1-2-20-12(17)11(13-21-7-8-22-13)15-14-9-3-5-10(6-4-9)16(18)19/h3-6H,2,7-8H2,1H3