dodecyl (2S)-3-phenyl-2-(prop-2-enoxycarbonylamino)propanoate

Systemtic Name: dodecyl (2S)-3-phenyl-2-(prop-2-enoxycarbonylamino)propanoate Openeye Name: dodecyl (2S)-2-(allyloxycarbonylamino)-3-phenyl-propanoate CAS Name: (2S)-2-[[oxo(prop-2-enoxy)methyl]amino]-3-phenylpropanoic acid dodecyl ester IUPAC Name: dodecyl (2S)-3-phenyl-2-(prop-2-enoxycarbonylamino)propanoate Traditional Name: (2S)-2-(allyloxycarbonylamino)-3-phenyl-propionic acid lauryl ester Formula: C25H39NO4 MolecularWeight: 417.58146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(CC1=CC=CC=C1)NC(=O)OCC=C

Isomeric SMILES

CCCCCCCCCCCCOC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC=C

InChI

InChI=1S/C25H39NO4/c1-3-5-6-7-8-9-10-11-12-16-20-29-24(27)23(26-25(28)30-19-4-2)21-22-17-14-13-15-18-22/h4,13-15,17-18,23H,2-3,5-12,16,19-21H2,1H3,(H,26,28)/t23-/m0/s1