(2S,3S)-2-(3,5-dimethylphenoxy)pentan-3-amine

Systemtic Name: (2S,3S)-2-(3,5-dimethylphenoxy)pentan-3-amine Openeye Name: (2S,3S)-2-(3,5-dimethylphenoxy)pentan-3-amine CAS Name: (2S,3S)-2-(3,5-dimethylphenoxy)-3-pentanamine IUPAC Name: (2S,3S)-2-(3,5-dimethylphenoxy)pentan-3-amine Traditional Name: [(1S,2S)-2-(3,5-dimethylphenoxy)-1-ethyl-propyl]amine Formula: C13H21NO MolecularWeight: 207.31194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)OC1=CC(=CC(=C1)C)C)N

Isomeric SMILES

CC[C@@H]([C@H](C)OC1=CC(=CC(=C1)C)C)N

InChI

InChI=1S/C13H21NO/c1-5-13(14)11(4)15-12-7-9(2)6-10(3)8-12/h6-8,11,13H,5,14H2,1-4H3/t11-,13-/m0/s1