(4-bromanyl-2-chloranyl-phenyl) 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: (4-bromo-2-chloro-phenyl) 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid (4-bromo-2-chloro-phenyl) ester Formula: C17H14BrClN2O5 MolecularWeight: 441.66046

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)OC3=C(C=C(C=C3)Br)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)OC3=C(C=C(C=C3)Br)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H14BrClN2O5/c18-12-2-4-16(13(19)10-12)26-17(22)11-1-3-14(15(9-11)21(23)24)20-5-7-25-8-6-20/h1-4,9-10H,5-8H2