[(3R)-4-azanyl-3-cyano-2-oxidanylidene-pent-4-enyl] 2-(2-nitrophenoxy)ethanoate

Systemtic Name: [(3R)-4-azanyl-3-cyano-2-oxidanylidene-pent-4-enyl] 2-(2-nitrophenoxy)ethanoate Openeye Name: [(3R)-4-amino-3-cyano-2-oxo-pent-4-enyl] 2-(2-nitrophenoxy)acetate CAS Name: 2-(2-nitrophenoxy)acetic acid [(3R)-4-amino-3-cyano-2-oxopent-4-enyl] ester IUPAC Name: [(3R)-4-amino-3-cyano-2-oxopent-4-enyl] 2-(2-nitrophenoxy)acetate Traditional Name: 2-(2-nitrophenoxy)acetic acid [(3R)-4-amino-3-cyano-2-keto-pent-4-enyl] ester Formula: C14H13N3O6 MolecularWeight: 319.26952

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(C#N)C(=O)COC(=O)COC1=CC=CC=C1[N+](=O)[O-])N

Isomeric SMILES

C=C([C@H](C#N)C(=O)COC(=O)COC1=CC=CC=C1[N+](=O)[O-])N

InChI

InChI=1S/C14H13N3O6/c1-9(16)10(6-15)12(18)7-23-14(19)8-22-13-5-3-2-4-11(13)17(20)21/h2-5,10H,1,7-8,16H2/t10-/m0/s1