prop-2-enyl (2R,3S)-2-ethyl-3-[[(1S)-1-phenylethyl]carbamoyl]hex-5-enoate

Systemtic Name: prop-2-enyl (2R,3S)-2-ethyl-3-[[(1S)-1-phenylethyl]carbamoyl]hex-5-enoate Openeye Name: allyl (2R,3S)-2-ethyl-3-[[(1S)-1-phenylethyl]carbamoyl]hex-5-enoate CAS Name: (2R,3S)-2-ethyl-3-[oxo-[[(1S)-1-phenylethyl]amino]methyl]-5-hexenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2R,3S)-2-ethyl-3-[[(1S)-1-phenylethyl]carbamoyl]hex-5-enoate Traditional Name: (2R,3S)-2-ethyl-3-[[(1S)-1-phenylethyl]carbamoyl]hex-5-enoic acid allyl ester Formula: C20H27NO3 MolecularWeight: 329.43328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC=C)C(=O)NC(C)C1=CC=CC=C1)C(=O)OCC=C

Isomeric SMILES

CC[C@H]([C@H](CC=C)C(=O)N[C@@H](C)C1=CC=CC=C1)C(=O)OCC=C

InChI

InChI=1S/C20H27NO3/c1-5-11-18(17(7-3)20(23)24-14-6-2)19(22)21-15(4)16-12-9-8-10-13-16/h5-6,8-10,12-13,15,17-18H,1-2,7,11,14H2,3-4H3,(H,21,22)/t15-,17+,18-/m0/s1