(4-cyclohexylphenyl) 3,5-dinitrobenzoate

Systemtic Name: (4-cyclohexylphenyl) 3,5-dinitrobenzoate Openeye Name: (4-cyclohexylphenyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (4-cyclohexylphenyl) ester IUPAC Name: (4-cyclohexylphenyl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (4-cyclohexylphenyl) ester Formula: C19H18N2O6 MolecularWeight: 370.35602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O6/c22-19(15-10-16(20(23)24)12-17(11-15)21(25)26)27-18-8-6-14(7-9-18)13-4-2-1-3-5-13/h6-13H,1-5H2