(4-cyclohexylphenyl) 2,4-dinitrobenzoate

Systemtic Name: (4-cyclohexylphenyl) 2,4-dinitrobenzoate Openeye Name: (4-cyclohexylphenyl) 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid (4-cyclohexylphenyl) ester IUPAC Name: (4-cyclohexylphenyl) 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid (4-cyclohexylphenyl) ester Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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