phenacyl 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: phenacyl 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: phenacyl 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid phenacyl ester IUPAC Name: phenacyl 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid phenacyl ester Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O6/c22-18(14-4-2-1-3-5-14)13-27-19(23)16-12-15(21(24)25)6-7-17(16)20-8-10-26-11-9-20/h1-7,12H,8-11,13H2