(4-propan-2-ylphenyl) 3-nitrobenzoate

Systemtic Name: (4-propan-2-ylphenyl) 3-nitrobenzoate Openeye Name: (4-isopropylphenyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (4-propan-2-ylphenyl) ester IUPAC Name: (4-propan-2-ylphenyl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid p-cumenyl ester Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO4/c1-11(2)12-6-8-15(9-7-12)21-16(18)13-4-3-5-14(10-13)17(19)20/h3-11H,1-2H3