2-cyclohexylpropyl 4-nitrobenzoate

Systemtic Name: 2-cyclohexylpropyl 4-nitrobenzoate Openeye Name: 2-cyclohexylpropyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2-cyclohexylpropyl ester IUPAC Name: 2-cyclohexylpropyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 2-cyclohexylpropyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])C2CCCCC2

Isomeric SMILES

CC(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])C2CCCCC2

InChI

InChI=1S/C16H21NO4/c1-12(13-5-3-2-4-6-13)11-21-16(18)14-7-9-15(10-8-14)17(19)20/h7-10,12-13H,2-6,11H2,1H3