2-(3-methylbutylsulfanyl)ethanamine; 2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: 2-(3-methylbutylsulfanyl)ethanamine; 2-oxidanyl-2-phenyl-ethanoate Openeye Name: 2-hydroxy-2-phenyl-acetate; 2-isopentylsulfanylethanamine CAS Name: 2-hydroxy-2-phenylacetate; 2-(3-methylbutylthio)ethanamine IUPAC Name: 2-hydroxy-2-phenylacetate; 2-(3-methylbutylsulfanyl)ethanamine Traditional Name: 2-hydroxy-2-phenyl-acetate; 2-(isoamylthio)ethylamine Formula: C15H24NO3S- MolecularWeight: 298.42096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSCCN.C1=CC=C(C=C1)C(C(=O)[O-])O

Isomeric SMILES

CC(C)CCSCCN.C1=CC=C(C=C1)C(C(=O)[O-])O

InChI

InChI=1S/C8H8O3.C7H17NS/c9-7(8(10)11)6-4-2-1-3-5-6;1-7(2)3-5-9-6-4-8/h1-5,7,9H,(H,10,11);7H,3-6,8H2,1-2H3/p-1