2-[[1-methyl-4-(4-methylpentyl)cyclohexyl]carbonylamino]butanoic acid

Systemtic Name: 2-[[1-methyl-4-(4-methylpentyl)cyclohexyl]carbonylamino]butanoic acid Openeye Name: 2-[(4-isohexyl-1-methyl-cyclohexanecarbonyl)amino]butanoic acid CAS Name: 2-[[[1-methyl-4-(4-methylpentyl)cyclohexyl]-oxomethyl]amino]butanoic acid IUPAC Name: 2-[[1-methyl-4-(4-methylpentyl)cyclohexanecarbonyl]amino]butanoic acid Traditional Name: 2-[(4-isohexyl-1-methyl-cyclohexanecarbonyl)amino]butyric acid Formula: C18H33NO3 MolecularWeight: 311.45952

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1(CCC(CC1)CCCC(C)C)C

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1(CCC(CC1)CCCC(C)C)C

InChI

InChI=1S/C18H33NO3/c1-5-15(16(20)21)19-17(22)18(4)11-9-14(10-12-18)8-6-7-13(2)3/h13-15H,5-12H2,1-4H3,(H,19,22)(H,20,21)