(3,4-dichlorophenyl)methyl 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: (3,4-dichlorophenyl)methyl 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: (3,4-dichlorophenyl)methyl 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid (3,4-dichlorophenyl)methyl ester IUPAC Name: (3,4-dichlorophenyl)methyl 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid (3,4-dichlorobenzyl) ester Formula: C18H16Cl2N2O5 MolecularWeight: 411.23604

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)OCC3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)OCC3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H16Cl2N2O5/c19-14-3-1-12(9-15(14)20)11-27-18(23)13-2-4-16(17(10-13)22(24)25)21-5-7-26-8-6-21/h1-4,9-10H,5-8,11H2