[(E)-4-oxidanylidenepent-2-en-2-yl] 2-(2-nitrophenyl)ethanoate

Systemtic Name: [(E)-4-oxidanylidenepent-2-en-2-yl] 2-(2-nitrophenyl)ethanoate Openeye Name: [(E)-1-methyl-3-oxo-but-1-enyl] 2-(2-nitrophenyl)acetate CAS Name: 2-(2-nitrophenyl)acetic acid [(E)-4-oxopent-2-en-2-yl] ester IUPAC Name: [(E)-4-oxopent-2-en-2-yl] 2-(2-nitrophenyl)acetate Traditional Name: 2-(2-nitrophenyl)acetic acid [(E)-3-keto-1-methyl-but-1-enyl] ester Formula: C13H13NO5 MolecularWeight: 263.24602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO5/c1-9(15)7-10(2)19-13(16)8-11-5-3-4-6-12(11)14(17)18/h3-7H,8H2,1-2H3/b10-7+