(4-aminocarbonyl-2-nitro-phenyl)methyl 4-(phenoxymethyl)benzoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 4-(phenoxymethyl)benzoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 4-(phenoxymethyl)benzoate CAS Name: 4-(phenoxymethyl)benzoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 4-(phenoxymethyl)benzoate Traditional Name: 4-(phenoxymethyl)benzoic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C22H18N2O6 MolecularWeight: 406.38812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C22H18N2O6/c23-21(25)17-10-11-18(20(12-17)24(27)28)14-30-22(26)16-8-6-15(7-9-16)13-29-19-4-2-1-3-5-19/h1-12H,13-14H2,(H2,23,25)