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

Systemtic Name: hexyl (2S)-3-phenyl-2-(prop-2-enoxycarbonylamino)propanoate Openeye Name: hexyl (2S)-2-(allyloxycarbonylamino)-3-phenyl-propanoate CAS Name: (2S)-2-[[oxo(prop-2-enoxy)methyl]amino]-3-phenylpropanoic acid hexyl ester IUPAC Name: hexyl (2S)-3-phenyl-2-(prop-2-enoxycarbonylamino)propanoate Traditional Name: (2S)-2-(allyloxycarbonylamino)-3-phenyl-propionic acid hexyl ester Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27NO4/c1-3-5-6-10-14-23-18(21)17(20-19(22)24-13-4-2)15-16-11-8-7-9-12-16/h4,7-9,11-12,17H,2-3,5-6,10,13-15H2,1H3,(H,20,22)/t17-/m0/s1