methyl 2,4,6-trimethyl-3-nitro-benzoate

Systemtic Name: methyl 2,4,6-trimethyl-3-nitro-benzoate Openeye Name: methyl 2,4,6-trimethyl-3-nitro-benzoate CAS Name: 2,4,6-trimethyl-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 2,4,6-trimethyl-3-nitrobenzoate Traditional Name: 2,4,6-trimethyl-3-nitro-benzoic acid methyl ester Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)OC)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)OC)C)[N+](=O)[O-])C

InChI

InChI=1S/C11H13NO4/c1-6-5-7(2)10(12(14)15)8(3)9(6)11(13)16-4/h5H,1-4H3