1-butyl-4-cyclohexyl-cyclohexane; (4-propylphenyl) hydrogen carbonate

Systemtic Name: 1-butyl-4-cyclohexyl-cyclohexane; (4-propylphenyl) hydrogen carbonate Openeye Name: 1-butyl-4-cyclohexyl-cyclohexane; (4-propylphenyl) hydrogen carbonate CAS Name: 1-butyl-4-cyclohexylcyclohexane; carbonic acid (4-propylphenyl) ester IUPAC Name: 1-butyl-4-cyclohexylcyclohexane; (4-propylphenyl) hydrogen carbonate Traditional Name: 1-butyl-4-cyclohexyl-cyclohexane; carbonic acid (4-propylphenyl) ester Formula: C26H42O3 MolecularWeight: 402.60988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2CCCCC2.CCCC1=CC=C(C=C1)OC(=O)O

Isomeric SMILES

CCCCC1CCC(CC1)C2CCCCC2.CCCC1=CC=C(C=C1)OC(=O)O

InChI

InChI=1S/C16H30.C10H12O3/c1-2-3-7-14-10-12-16(13-11-14)15-8-5-4-6-9-15;1-2-3-8-4-6-9(7-5-8)13-10(11)12/h14-16H,2-13H2,1H3;4-7H,2-3H2,1H3,(H,11,12)