methyl (2S)-2-(hexylamino)-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-(hexylamino)-3-phenyl-propanoate Openeye Name: methyl (2S)-2-(hexylamino)-3-phenyl-propanoate CAS Name: (2S)-2-(hexylamino)-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-(hexylamino)-3-phenylpropanoate Traditional Name: (2S)-2-(hexylamino)-3-phenyl-propionic acid methyl ester Formula: C16H25NO2 MolecularWeight: 263.3752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCCCCCN[C@@H](CC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C16H25NO2/c1-3-4-5-9-12-17-15(16(18)19-2)13-14-10-7-6-8-11-14/h6-8,10-11,15,17H,3-5,9,12-13H2,1-2H3/t15-/m0/s1