cyclohexylmethyl 2,4-dinitrobenzoate

Systemtic Name: cyclohexylmethyl 2,4-dinitrobenzoate Openeye Name: cyclohexylmethyl 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid cyclohexylmethyl ester Formula: C14H16N2O6 MolecularWeight: 308.28664

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)COC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O6/c17-14(22-9-10-4-2-1-3-5-10)12-7-6-11(15(18)19)8-13(12)16(20)21/h6-8,10H,1-5,9H2