2-[(3,5-dinitrophenyl)methyl]prop-2-enyl ethanoate

Systemtic Name: 2-[(3,5-dinitrophenyl)methyl]prop-2-enyl ethanoate Openeye Name: 2-[(3,5-dinitrophenyl)methyl]allyl acetate CAS Name: acetic acid 2-[(3,5-dinitrophenyl)methyl]prop-2-enyl ester IUPAC Name: 2-[(3,5-dinitrophenyl)methyl]prop-2-enyl acetate Traditional Name: acetic acid 2-(3,5-dinitrobenzyl)allyl ester Formula: C12H12N2O6 MolecularWeight: 280.23348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O6/c1-8(7-20-9(2)15)3-10-4-11(13(16)17)6-12(5-10)14(18)19/h4-6H,1,3,7H2,2H3