(2S)-2-[[4-(4-methylpentyl)cyclohexyl]carbonylamino]propanoic acid

Systemtic Name: (2S)-2-[[4-(4-methylpentyl)cyclohexyl]carbonylamino]propanoic acid Openeye Name: (2S)-2-[(4-isohexylcyclohexanecarbonyl)amino]propanoic acid CAS Name: (2S)-2-[[[4-(4-methylpentyl)cyclohexyl]-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-2-[[4-(4-methylpentyl)cyclohexanecarbonyl]amino]propanoic acid Traditional Name: (2S)-2-[(4-isohexylcyclohexanecarbonyl)amino]propionic acid Formula: C16H29NO3 MolecularWeight: 283.40636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC1CCC(CC1)C(=O)NC(C)C(=O)O

Isomeric SMILES

C[C@@H](C(=O)O)NC(=O)C1CCC(CC1)CCCC(C)C

InChI

InChI=1S/C16H29NO3/c1-11(2)5-4-6-13-7-9-14(10-8-13)15(18)17-12(3)16(19)20/h11-14H,4-10H2,1-3H3,(H,17,18)(H,19,20)/t12-,13?,14?/m0/s1