(2-methylphenyl)methyl 4-methyl-3-nitro-benzoate

Systemtic Name: (2-methylphenyl)methyl 4-methyl-3-nitro-benzoate Openeye Name: o-tolylmethyl 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid (2-methylbenzyl) ester Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2C)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO4/c1-11-5-3-4-6-14(11)10-21-16(18)13-8-7-12(2)15(9-13)17(19)20/h3-9H,10H2,1-2H3