3-cyclohexyl-2-[[4-methoxy-1-(sulfanylmethyl)cyclohexyl]carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-2-[[4-methoxy-1-(sulfanylmethyl)cyclohexyl]carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-2-[[4-methoxy-1-(sulfanylmethyl)cyclohexanecarbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-2-[[[1-(mercaptomethyl)-4-methoxycyclohexyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-2-[[4-methoxy-1-(sulfanylmethyl)cyclohexanecarbonyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-2-[[1-(mercaptomethyl)-4-methoxy-cyclohexanecarbonyl]amino]propionic acid Formula: C18H31NO4S MolecularWeight: 357.50804

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCC(CC1)(CS)C(=O)NC(CC2CCCCC2)C(=O)O

Isomeric SMILES

COC1CCC(CC1)(CS)C(=O)NC(CC2CCCCC2)C(=O)O

InChI

InChI=1S/C18H31NO4S/c1-23-14-7-9-18(12-24,10-8-14)17(22)19-15(16(20)21)11-13-5-3-2-4-6-13/h13-15,24H,2-12H2,1H3,(H,19,22)(H,20,21)