(2-cyclohexyl-4,6-dinitro-phenyl) propanoate

Systemtic Name: (2-cyclohexyl-4,6-dinitro-phenyl) propanoate Openeye Name: (2-cyclohexyl-4,6-dinitro-phenyl) propanoate CAS Name: propanoic acid (2-cyclohexyl-4,6-dinitrophenyl) ester IUPAC Name: (2-cyclohexyl-4,6-dinitrophenyl) propanoate Traditional Name: propionic acid (2-cyclohexyl-4,6-dinitro-phenyl) ester Formula: C15H18N2O6 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C=C(C=C1C2CCCCC2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC(=O)OC1=C(C=C(C=C1C2CCCCC2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O6/c1-2-14(18)23-15-12(10-6-4-3-5-7-10)8-11(16(19)20)9-13(15)17(21)22/h8-10H,2-7H2,1H3