2-[1-[[1-(2-oxidanylidene-3-phenyl-propanoyl)oxypropoxycarbonylamino]methyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-[[1-(2-oxidanylidene-3-phenyl-propanoyl)oxypropoxycarbonylamino]methyl]cyclohexyl]ethanoic acid Openeye Name: 2-[1-[[1-(2-oxo-3-phenyl-propanoyl)oxypropoxycarbonylamino]methyl]cyclohexyl]acetic acid CAS Name: 2-[1-[[[1-(1,2-dioxo-3-phenylpropoxy)propoxy-oxomethyl]amino]methyl]cyclohexyl]acetic acid IUPAC Name: 2-[1-[[1-(2-oxo-3-phenylpropanoyl)oxypropoxycarbonylamino]methyl]cyclohexyl]acetic acid Traditional Name: 2-[1-[[1-(2-keto-3-phenyl-propanoyl)oxypropoxycarbonylamino]methyl]cyclohexyl]acetic acid Formula: C22H29NO7 MolecularWeight: 419.46816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29NO7/c1-2-19(29-20(27)17(24)13-16-9-5-3-6-10-16)30-21(28)23-15-22(14-18(25)26)11-7-4-8-12-22/h3,5-6,9-10,19H,2,4,7-8,11-15H2,1H3,(H,23,28)(H,25,26)