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

Systemtic Name: pentadecyl (2S)-2-[(4-methylphenyl)carbonylamino]propanoate Openeye Name: pentadecyl (2S)-2-[(4-methylbenzoyl)amino]propanoate CAS Name: (2S)-2-[[(4-methylphenyl)-oxomethyl]amino]propanoic acid pentadecyl ester IUPAC Name: pentadecyl (2S)-2-[(4-methylbenzoyl)amino]propanoate Traditional Name: (2S)-2-(p-toluoylamino)propionic acid pentadecyl ester Formula: C26H43NO3 MolecularWeight: 417.62452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H43NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-21-30-26(29)23(3)27-25(28)24-19-17-22(2)18-20-24/h17-20,23H,4-16,21H2,1-3H3,(H,27,28)/t23-/m0/s1