2-[[4-(4-methylpentyl)cyclohexyl]carbonylamino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[[4-(4-methylpentyl)cyclohexyl]carbonylamino]-3-sulfanyl-propanoic acid Openeye Name: 2-[(4-isohexylcyclohexanecarbonyl)amino]-3-sulfanyl-propanoic acid CAS Name: 3-mercapto-2-[[[4-(4-methylpentyl)cyclohexyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[[4-(4-methylpentyl)cyclohexanecarbonyl]amino]-3-sulfanylpropanoic acid Traditional Name: 2-[(4-isohexylcyclohexanecarbonyl)amino]-3-mercapto-propionic acid Formula: C16H29NO3S MolecularWeight: 315.47136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H29NO3S/c1-11(2)4-3-5-12-6-8-13(9-7-12)15(18)17-14(10-21)16(19)20/h11-14,21H,3-10H2,1-2H3,(H,17,18)(H,19,20)