methyl 2,4-dimethyl-5-nitro-benzoate

Systemtic Name: methyl 2,4-dimethyl-5-nitro-benzoate Openeye Name: methyl 2,4-dimethyl-5-nitro-benzoate CAS Name: 2,4-dimethyl-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-nitrobenzoate Traditional Name: 2,4-dimethyl-5-nitro-benzoic acid methyl ester Formula: C10H11NO4 MolecularWeight: 209.19864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO4/c1-6-4-7(2)9(11(13)14)5-8(6)10(12)15-3/h4-5H,1-3H3