phenacyl 4-ethoxy-3-nitro-benzoate

Systemtic Name: phenacyl 4-ethoxy-3-nitro-benzoate Openeye Name: phenacyl 4-ethoxy-3-nitro-benzoate CAS Name: 4-ethoxy-3-nitrobenzoic acid phenacyl ester IUPAC Name: phenacyl 4-ethoxy-3-nitrobenzoate Traditional Name: 4-ethoxy-3-nitro-benzoic acid phenacyl ester Formula: C17H15NO6 MolecularWeight: 329.3041

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO6/c1-2-23-16-9-8-13(10-14(16)18(21)22)17(20)24-11-15(19)12-6-4-3-5-7-12/h3-10H,2,11H2,1H3