ethyl 4-butanoyloxy-4-(nitromethyl)cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-butanoyloxy-4-(nitromethyl)cyclohexane-1-carboxylate Openeye Name: ethyl 4-butanoyloxy-4-(nitromethyl)cyclohexanecarboxylate CAS Name: 4-(nitromethyl)-4-(1-oxobutoxy)-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-butanoyloxy-4-(nitromethyl)cyclohexane-1-carboxylate Traditional Name: 4-butyryloxy-4-(nitromethyl)cyclohexanecarboxylic acid ethyl ester Formula: C14H23NO6 MolecularWeight: 301.33552

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1(CCC(CC1)C(=O)OCC)C[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)OC1(CCC(CC1)C(=O)OCC)C[N+](=O)[O-]

InChI

InChI=1S/C14H23NO6/c1-3-5-12(16)21-14(10-15(18)19)8-6-11(7-9-14)13(17)20-4-2/h11H,3-10H2,1-2H3