3-[2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: 3-[2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: 3-[2-[[4-(1,1-dimethylpropyl)cyclohexyl]amino]-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]-2-oxoethyl]thio]propanoate IUPAC Name: 3-[2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-[(4-tert-amylcyclohexyl)amino]-2-keto-ethyl]thio]propionate Formula: C16H28NO3S- MolecularWeight: 314.46342

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(CC1)NC(=O)CSCCC(=O)[O-]

Isomeric SMILES

CCC(C)(C)C1CCC(CC1)NC(=O)CSCCC(=O)[O-]

InChI

InChI=1S/C16H29NO3S/c1-4-16(2,3)12-5-7-13(8-6-12)17-14(18)11-21-10-9-15(19)20/h12-13H,4-11H2,1-3H3,(H,17,18)(H,19,20)/p-1