(4-phenoxyphenyl) 3-methyl-4-nitro-benzoate

Systemtic Name: (4-phenoxyphenyl) 3-methyl-4-nitro-benzoate Openeye Name: (4-phenoxyphenyl) 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid (4-phenoxyphenyl) ester IUPAC Name: (4-phenoxyphenyl) 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid (4-phenoxyphenyl) ester Formula: C20H15NO5 MolecularWeight: 349.3368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)OC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)OC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H15NO5/c1-14-13-15(7-12-19(14)21(23)24)20(22)26-18-10-8-17(9-11-18)25-16-5-3-2-4-6-16/h2-13H,1H3