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

Systemtic Name: (2,3,6-trimethylphenyl) 2-(4-nitrophenyl)ethanoate Openeye Name: (2,3,6-trimethylphenyl) 2-(4-nitrophenyl)acetate CAS Name: 2-(4-nitrophenyl)acetic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 2-(4-nitrophenyl)acetate Traditional Name: 2-(4-nitrophenyl)acetic acid (2,3,6-trimethylphenyl) ester Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H17NO4/c1-11-4-5-12(2)17(13(11)3)22-16(19)10-14-6-8-15(9-7-14)18(20)21/h4-9H,10H2,1-3H3