(2-methylphenyl)methyl 3-nitrobenzoate

Systemtic Name: (2-methylphenyl)methyl 3-nitrobenzoate Openeye Name: o-tolylmethyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2-methylbenzyl) ester Formula: C15H13NO4 MolecularWeight: 271.26802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1COC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H13NO4/c1-11-5-2-3-6-13(11)10-20-15(17)12-7-4-8-14(9-12)16(18)19/h2-9H,10H2,1H3