(3-chlorophenyl)methyl 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: (3-chlorophenyl)methyl 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: (3-chlorophenyl)methyl 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid (3-chlorophenyl)methyl ester IUPAC Name: (3-chlorophenyl)methyl 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid (3-chlorobenzyl) ester Formula: C18H17ClN2O5 MolecularWeight: 376.79098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN2O5/c19-15-3-1-2-13(10-15)12-26-18(22)14-4-5-16(17(11-14)21(23)24)20-6-8-25-9-7-20/h1-5,10-11H,6-9,12H2