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

Systemtic Name: phenacyl 2-(dimethylamino)-5-nitro-benzoate Openeye Name: phenacyl 2-(dimethylamino)-5-nitro-benzoate CAS Name: 2-(dimethylamino)-5-nitrobenzoic acid phenacyl ester IUPAC Name: phenacyl 2-(dimethylamino)-5-nitrobenzoate Traditional Name: 2-(dimethylamino)-5-nitro-benzoic acid phenacyl ester Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O5/c1-18(2)15-9-8-13(19(22)23)10-14(15)17(21)24-11-16(20)12-6-4-3-5-7-12/h3-10H,11H2,1-2H3