(4-ethanoyl-2-methoxy-phenyl) 3-methyl-4-nitro-benzoate

Systemtic Name: (4-ethanoyl-2-methoxy-phenyl) 3-methyl-4-nitro-benzoate Openeye Name: (4-acetyl-2-methoxy-phenyl) 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid (4-acetyl-2-methoxyphenyl) ester IUPAC Name: (4-acetyl-2-methoxyphenyl) 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid (4-acetyl-2-methoxy-phenyl) ester Formula: C17H15NO6 MolecularWeight: 329.3041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC2=C(C=C(C=C2)C(=O)C)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC2=C(C=C(C=C2)C(=O)C)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO6/c1-10-8-13(4-6-14(10)18(21)22)17(20)24-15-7-5-12(11(2)19)9-16(15)23-3/h4-9H,1-3H3