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

Systemtic Name: octadecyl (2S)-2-[(4-methylphenyl)carbonylamino]propanoate Openeye Name: octadecyl (2S)-2-[(4-methylbenzoyl)amino]propanoate CAS Name: (2S)-2-[[(4-methylphenyl)-oxomethyl]amino]propanoic acid octadecyl ester IUPAC Name: octadecyl (2S)-2-[(4-methylbenzoyl)amino]propanoate Traditional Name: (2S)-2-(p-toluoylamino)propionic acid stearyl ester Formula: C29H49NO3 MolecularWeight: 459.70426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H49NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-33-29(32)26(3)30-28(31)27-22-20-25(2)21-23-27/h20-23,26H,4-19,24H2,1-3H3,(H,30,31)/t26-/m0/s1