(Z,3R,4S)-5-azanyl-3-(4-chlorophenyl)-4-cyano-1-ethoxy-2-nitro-5-sulfanylidene-pent-1-en-1-olate

Systemtic Name: (Z,3R,4S)-5-azanyl-3-(4-chlorophenyl)-4-cyano-1-ethoxy-2-nitro-5-sulfanylidene-pent-1-en-1-olate Openeye Name: (Z,3R,4S)-5-amino-3-(4-chlorophenyl)-4-cyano-1-ethoxy-2-nitro-5-thioxo-pent-1-en-1-olate CAS Name: (Z,3R,4S)-5-amino-3-(4-chlorophenyl)-4-cyano-1-ethoxy-2-nitro-5-sulfanylidene-1-penten-1-olate IUPAC Name: (Z,3R,4S)-5-amino-3-(4-chlorophenyl)-4-cyano-1-ethoxy-2-nitro-5-sulfanylidenepent-1-en-1-olate Traditional Name: (Z,3R,4S)-5-amino-3-(4-chlorophenyl)-4-cyano-1-ethoxy-2-nitro-5-thioxo-pent-1-en-1-olate Formula: C14H13ClN3O4S- MolecularWeight: 354.78872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(C1=CC=C(C=C1)Cl)C(C#N)C(=S)N)[N+](=O)[O-])[O-]

Isomeric SMILES

CCO/C(=C(/[C@@H](C1=CC=C(C=C1)Cl)[C@@H](C#N)C(=S)N)\[N+](=O)[O-])/[O-]

InChI

InChI=1S/C14H14ClN3O4S/c1-2-22-14(19)12(18(20)21)11(10(7-16)13(17)23)8-3-5-9(15)6-4-8/h3-6,10-11,19H,2H2,1H3,(H2,17,23)/p-1/b14-12-/t10-,11+/m1/s1