(3-nitrophenyl) 2-(2,4,6-trimethylphenoxy)ethanoate

Systemtic Name: (3-nitrophenyl) 2-(2,4,6-trimethylphenoxy)ethanoate Openeye Name: (3-nitrophenyl) 2-(2,4,6-trimethylphenoxy)acetate CAS Name: 2-(2,4,6-trimethylphenoxy)acetic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 2-(2,4,6-trimethylphenoxy)acetate Traditional Name: 2-(2,4,6-trimethylphenoxy)acetic acid (3-nitrophenyl) ester Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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