(3,5-dimethylphenyl) 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: (3,5-dimethylphenyl) 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: (3,5-dimethylphenyl) 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid (3,5-dimethylphenyl) ester Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O5/c1-13-9-14(2)11-16(10-13)26-19(22)17-12-15(21(23)24)3-4-18(17)20-5-7-25-8-6-20/h3-4,9-12H,5-8H2,1-2H3