1-azanyl-2-methyl-2-(phenylmethylsulfanyl)cyclohexane-1-carboxylic acid

Systemtic Name: 1-azanyl-2-methyl-2-(phenylmethylsulfanyl)cyclohexane-1-carboxylic acid Openeye Name: 1-amino-2-benzylsulfanyl-2-methyl-cyclohexanecarboxylic acid CAS Name: 1-amino-2-methyl-2-(phenylmethylthio)-1-cyclohexanecarboxylic acid IUPAC Name: 1-amino-2-benzylsulfanyl-2-methylcyclohexane-1-carboxylic acid Traditional Name: 1-amino-2-(benzylthio)-2-methyl-cyclohexanecarboxylic acid Formula: C15H21NO2S MolecularWeight: 279.39774

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1(C(=O)O)N)SCC2=CC=CC=C2

Isomeric SMILES

CC1(CCCCC1(C(=O)O)N)SCC2=CC=CC=C2

InChI

InChI=1S/C15H21NO2S/c1-14(19-11-12-7-3-2-4-8-12)9-5-6-10-15(14,16)13(17)18/h2-4,7-8H,5-6,9-11,16H2,1H3,(H,17,18)