ethyl 2-[(1R,3S)-3-methyl-1-(nitromethyl)cyclohexyl]ethanoate

Systemtic Name: ethyl 2-[(1R,3S)-3-methyl-1-(nitromethyl)cyclohexyl]ethanoate Openeye Name: ethyl 2-[(1R,3S)-3-methyl-1-(nitromethyl)cyclohexyl]acetate CAS Name: 2-[(1R,3S)-3-methyl-1-(nitromethyl)cyclohexyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1R,3S)-3-methyl-1-(nitromethyl)cyclohexyl]acetate Traditional Name: 2-[(1R,3S)-3-methyl-1-(nitromethyl)cyclohexyl]acetic acid ethyl ester Formula: C12H21NO4 MolecularWeight: 243.29944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(CCCC(C1)C)C[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C[C@]1(CCC[C@@H](C1)C)C[N+](=O)[O-]

InChI

InChI=1S/C12H21NO4/c1-3-17-11(14)8-12(9-13(15)16)6-4-5-10(2)7-12/h10H,3-9H2,1-2H3/t10-,12+/m0/s1