2-[1-[[[1-(3-methylbutanoyloxy)-2-phenyl-ethoxy]carbonylamino]methyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-[[[1-(3-methylbutanoyloxy)-2-phenyl-ethoxy]carbonylamino]methyl]cyclohexyl]ethanoic acid Openeye Name: 2-[1-[[[1-(3-methylbutanoyloxy)-2-phenyl-ethoxy]carbonylamino]methyl]cyclohexyl]acetic acid CAS Name: 2-[1-[[[[1-(3-methyl-1-oxobutoxy)-2-phenylethoxy]-oxomethyl]amino]methyl]cyclohexyl]acetic acid IUPAC Name: 2-[1-[[[1-(3-methylbutanoyloxy)-2-phenylethoxy]carbonylamino]methyl]cyclohexyl]acetic acid Traditional Name: 2-[1-[[(1-isovaleryloxy-2-phenyl-ethoxy)carbonylamino]methyl]cyclohexyl]acetic acid Formula: C23H33NO6 MolecularWeight: 419.51122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OC(CC1=CC=CC=C1)OC(=O)NCC2(CCCCC2)CC(=O)O

Isomeric SMILES

CC(C)CC(=O)OC(CC1=CC=CC=C1)OC(=O)NCC2(CCCCC2)CC(=O)O

InChI

InChI=1S/C23H33NO6/c1-17(2)13-20(27)29-21(14-18-9-5-3-6-10-18)30-22(28)24-16-23(15-19(25)26)11-7-4-8-12-23/h3,5-6,9-10,17,21H,4,7-8,11-16H2,1-2H3,(H,24,28)(H,25,26)