(2,3,5-trimethylphenyl) 4-nitrobenzoate

Systemtic Name: (2,3,5-trimethylphenyl) 4-nitrobenzoate Openeye Name: (2,3,5-trimethylphenyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2,3,5-trimethylphenyl) ester IUPAC Name: (2,3,5-trimethylphenyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2,3,5-trimethylphenyl) ester Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO4/c1-10-8-11(2)12(3)15(9-10)21-16(18)13-4-6-14(7-5-13)17(19)20/h4-9H,1-3H3