(3-nitrophenyl) 3,4-dimethylbenzoate

Systemtic Name: (3-nitrophenyl) 3,4-dimethylbenzoate Openeye Name: (3-nitrophenyl) 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid (3-nitrophenyl) ester Formula: C15H13NO4 MolecularWeight: 271.26802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13NO4/c1-10-6-7-12(8-11(10)2)15(17)20-14-5-3-4-13(9-14)16(18)19/h3-9H,1-2H3