(4-methylphenyl) 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: (4-methylphenyl) 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: p-tolyl 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid p-tolyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C18H18N2O5/c1-13-2-5-15(6-3-13)25-18(21)16-12-14(20(22)23)4-7-17(16)19-8-10-24-11-9-19/h2-7,12H,8-11H2,1H3