methyl 4-(2,4-dimethylphenoxy)-3-nitro-benzoate

Systemtic Name: methyl 4-(2,4-dimethylphenoxy)-3-nitro-benzoate Openeye Name: methyl 4-(2,4-dimethylphenoxy)-3-nitro-benzoate CAS Name: 4-(2,4-dimethylphenoxy)-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-(2,4-dimethylphenoxy)-3-nitrobenzoate Traditional Name: 4-(2,4-dimethylphenoxy)-3-nitro-benzoic acid methyl ester Formula: C16H15NO5 MolecularWeight: 301.294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO5/c1-10-4-6-14(11(2)8-10)22-15-7-5-12(16(18)21-3)9-13(15)17(19)20/h4-9H,1-3H3