(2-ethanoyl-4-methyl-phenyl) 4-nitrobenzoate

Systemtic Name: (2-ethanoyl-4-methyl-phenyl) 4-nitrobenzoate Openeye Name: (2-acetyl-4-methyl-phenyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2-acetyl-4-methylphenyl) ester IUPAC Name: (2-acetyl-4-methylphenyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-acetyl-4-methyl-phenyl) ester Formula: C16H13NO5 MolecularWeight: 299.27812

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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(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO5/c1-10-3-8-15(14(9-10)11(2)18)22-16(19)12-4-6-13(7-5-12)17(20)21/h3-9H,1-2H3