hexyl (2S)-2-[(4-methylphenyl)carbonylamino]propanoate

Systemtic Name: hexyl (2S)-2-[(4-methylphenyl)carbonylamino]propanoate Openeye Name: hexyl (2S)-2-[(4-methylbenzoyl)amino]propanoate CAS Name: (2S)-2-[[(4-methylphenyl)-oxomethyl]amino]propanoic acid hexyl ester IUPAC Name: hexyl (2S)-2-[(4-methylbenzoyl)amino]propanoate Traditional Name: (2S)-2-(p-toluoylamino)propionic acid hexyl ester Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(C)NC(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCOC(=O)[C@H](C)NC(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C17H25NO3/c1-4-5-6-7-12-21-17(20)14(3)18-16(19)15-10-8-13(2)9-11-15/h8-11,14H,4-7,12H2,1-3H3,(H,18,19)/t14-/m0/s1