1-cyanobut-2-enyl 2-(4-nitrophenyl)ethanoate

Systemtic Name: 1-cyanobut-2-enyl 2-(4-nitrophenyl)ethanoate Openeye Name: 1-cyanobut-2-enyl 2-(4-nitrophenyl)acetate CAS Name: 2-(4-nitrophenyl)acetic acid 1-cyanobut-2-enyl ester IUPAC Name: 1-cyanobut-2-enyl 2-(4-nitrophenyl)acetate Traditional Name: 2-(4-nitrophenyl)acetic acid 1-cyanobut-2-enyl ester Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(C#N)OC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC=CC(C#N)OC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O4/c1-2-3-12(9-14)19-13(16)8-10-4-6-11(7-5-10)15(17)18/h2-7,12H,8H2,1H3