phenacyl 4-(dimethylamino)-3-nitro-benzoate

Systemtic Name: phenacyl 4-(dimethylamino)-3-nitro-benzoate Openeye Name: phenacyl 4-(dimethylamino)-3-nitro-benzoate CAS Name: 4-(dimethylamino)-3-nitrobenzoic acid phenacyl ester IUPAC Name: phenacyl 4-(dimethylamino)-3-nitrobenzoate Traditional Name: 4-(dimethylamino)-3-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)C(=O)OCC(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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