4-[3-[2-[cyclohexylcarbamoyl(heptyl)amino]ethoxy]cyclohexyl]-2,2-dimethyl-butanoate

Systemtic Name: 4-[3-[2-[cyclohexylcarbamoyl(heptyl)amino]ethoxy]cyclohexyl]-2,2-dimethyl-butanoate Openeye Name: 4-[3-[2-[cyclohexylcarbamoyl(heptyl)amino]ethoxy]cyclohexyl]-2,2-dimethyl-butanoate CAS Name: 4-[3-[2-[[(cyclohexylamino)-oxomethyl]-heptylamino]ethoxy]cyclohexyl]-2,2-dimethylbutanoate IUPAC Name: 4-[3-[2-[cyclohexylcarbamoyl(heptyl)amino]ethoxy]cyclohexyl]-2,2-dimethylbutanoate Traditional Name: 4-[3-[2-[cyclohexylcarbamoyl(heptyl)amino]ethoxy]cyclohexyl]-2,2-dimethyl-butyrate Formula: C28H51N2O4- MolecularWeight: 479.71554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCOC1CCCC(C1)CCC(C)(C)C(=O)[O-])C(=O)NC2CCCCC2

Isomeric SMILES

CCCCCCCN(CCOC1CCCC(C1)CCC(C)(C)C(=O)[O-])C(=O)NC2CCCCC2

InChI

InChI=1S/C28H52N2O4/c1-4-5-6-7-11-19-30(27(33)29-24-14-9-8-10-15-24)20-21-34-25-16-12-13-23(22-25)17-18-28(2,3)26(31)32/h23-25H,4-22H2,1-3H3,(H,29,33)(H,31,32)/p-1