(2-oxidanylidene-1,2-diphenyl-ethyl) 2-methoxy-5-nitro-benzoate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 2-methoxy-5-nitro-benzoate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 2-methoxy-5-nitro-benzoate CAS Name: 2-methoxy-5-nitrobenzoic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 2-methoxy-5-nitrobenzoate Traditional Name: 2-methoxy-5-nitro-benzoic acid desyl ester Formula: C22H17NO6 MolecularWeight: 391.37348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H17NO6/c1-28-19-13-12-17(23(26)27)14-18(19)22(25)29-21(16-10-6-3-7-11-16)20(24)15-8-4-2-5-9-15/h2-14,21H,1H3