(4-methylphenyl) 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: (4-methylphenyl) 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: p-tolyl 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-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=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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