(2-methylphenyl)methyl 4-nitrobenzoate

Systemtic Name: (2-methylphenyl)methyl 4-nitrobenzoate Openeye Name: o-tolylmethyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-methylbenzyl) ester Formula: C15H13NO4 MolecularWeight: 271.26802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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