(3,5-dimethylphenyl) 2-(3-methyl-4-nitro-phenoxy)ethanoate

Systemtic Name: (3,5-dimethylphenyl) 2-(3-methyl-4-nitro-phenoxy)ethanoate Openeye Name: (3,5-dimethylphenyl) 2-(3-methyl-4-nitro-phenoxy)acetate CAS Name: 2-(3-methyl-4-nitrophenoxy)acetic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 2-(3-methyl-4-nitrophenoxy)acetate Traditional Name: 2-(3-methyl-4-nitro-phenoxy)acetic acid (3,5-dimethylphenyl) ester Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C)C

InChI

InChI=1S/C17H17NO5/c1-11-6-12(2)8-15(7-11)23-17(19)10-22-14-4-5-16(18(20)21)13(3)9-14/h4-9H,10H2,1-3H3