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

Systemtic Name: octyl (2S)-2-[(4-methylphenyl)carbonylamino]propanoate Openeye Name: octyl (2S)-2-[(4-methylbenzoyl)amino]propanoate CAS Name: (2S)-2-[[(4-methylphenyl)-oxomethyl]amino]propanoic acid octyl ester IUPAC Name: octyl (2S)-2-[(4-methylbenzoyl)amino]propanoate Traditional Name: (2S)-2-(p-toluoylamino)propionic acid octyl ester Formula: C19H29NO3 MolecularWeight: 319.43846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29NO3/c1-4-5-6-7-8-9-14-23-19(22)16(3)20-18(21)17-12-10-15(2)11-13-17/h10-13,16H,4-9,14H2,1-3H3,(H,20,21)/t16-/m0/s1