2-oxidanylidenepropyl 2-(dimethylamino)-5-nitro-benzoate

Systemtic Name: 2-oxidanylidenepropyl 2-(dimethylamino)-5-nitro-benzoate Openeye Name: acetonyl 2-(dimethylamino)-5-nitro-benzoate CAS Name: 2-(dimethylamino)-5-nitrobenzoic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 2-(dimethylamino)-5-nitrobenzoate Traditional Name: 2-(dimethylamino)-5-nitro-benzoic acid acetonyl ester Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O5/c1-8(15)7-19-12(16)10-6-9(14(17)18)4-5-11(10)13(2)3/h4-6H,7H2,1-3H3