(3-methylphenyl) 4-nitrobenzoate

Systemtic Name: (3-methylphenyl) 4-nitrobenzoate Openeye Name: m-tolyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid m-tolyl ester Formula: C14H11NO4 MolecularWeight: 257.24144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H11NO4/c1-10-3-2-4-13(9-10)19-14(16)11-5-7-12(8-6-11)15(17)18/h2-9H,1H3