(3-ethyl-4-methyl-phenyl) 4-nitrobenzoate

Systemtic Name: (3-ethyl-4-methyl-phenyl) 4-nitrobenzoate Openeye Name: (3-ethyl-4-methyl-phenyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (3-ethyl-4-methylphenyl) ester IUPAC Name: (3-ethyl-4-methylphenyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (3-ethyl-4-methyl-phenyl) ester Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(C=CC(=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H15NO4/c1-3-12-10-15(9-4-11(12)2)21-16(18)13-5-7-14(8-6-13)17(19)20/h4-10H,3H2,1-2H3