[2-(2-oxidanylidenepropoxy)phenyl] 4-nitrobenzoate

Systemtic Name: [2-(2-oxidanylidenepropoxy)phenyl] 4-nitrobenzoate Openeye Name: (2-acetonyloxyphenyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-(2-oxopropoxy)phenyl] ester IUPAC Name: [2-(2-oxopropoxy)phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-acetonyloxyphenyl) ester Formula: C16H13NO6 MolecularWeight: 315.27752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)COC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO6/c1-11(18)10-22-14-4-2-3-5-15(14)23-16(19)12-6-8-13(9-7-12)17(20)21/h2-9H,10H2,1H3