2-[cycloheptyl-(2-methyl-3-sulfanyl-propanoyl)amino]ethanoic acid

Systemtic Name: 2-[cycloheptyl-(2-methyl-3-sulfanyl-propanoyl)amino]ethanoic acid Openeye Name: 2-[cycloheptyl-(2-methyl-3-sulfanyl-propanoyl)amino]acetic acid CAS Name: 2-[cycloheptyl-(3-mercapto-2-methyl-1-oxopropyl)amino]acetic acid IUPAC Name: 2-[cycloheptyl-(2-methyl-3-sulfanylpropanoyl)amino]acetic acid Traditional Name: 2-[cycloheptyl-(3-mercapto-2-methyl-propanoyl)amino]acetic acid Formula: C13H23NO3S MolecularWeight: 273.39162

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N(CC(=O)O)C1CCCCCC1

Isomeric SMILES

CC(CS)C(=O)N(CC(=O)O)C1CCCCCC1

InChI

InChI=1S/C13H23NO3S/c1-10(9-18)13(17)14(8-12(15)16)11-6-4-2-3-5-7-11/h10-11,18H,2-9H2,1H3,(H,15,16)