(phenylmethyl) 4-methyl-3,5-dinitro-benzoate

Systemtic Name: (phenylmethyl) 4-methyl-3,5-dinitro-benzoate Openeye Name: benzyl 4-methyl-3,5-dinitro-benzoate CAS Name: 4-methyl-3,5-dinitrobenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-methyl-3,5-dinitrobenzoate Traditional Name: 4-methyl-3,5-dinitro-benzoic acid benzyl ester Formula: C15H12N2O6 MolecularWeight: 316.26558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)OCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)OCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O6/c1-10-13(16(19)20)7-12(8-14(10)17(21)22)15(18)23-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3