ethyl (E,4S,5R)-4-methyl-5-[2-(phenylmethoxycarbonylamino)ethanoylamino]hex-2-enoate

Systemtic Name: ethyl (E,4S,5R)-4-methyl-5-[2-(phenylmethoxycarbonylamino)ethanoylamino]hex-2-enoate Openeye Name: ethyl (E,4S,5R)-5-[[2-(benzyloxycarbonylamino)acetyl]amino]-4-methyl-hex-2-enoate CAS Name: (E,4S,5R)-4-methyl-5-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]-2-hexenoic acid ethyl ester IUPAC Name: ethyl (E,4S,5R)-4-methyl-5-[[2-(phenylmethoxycarbonylamino)acetyl]amino]hex-2-enoate Traditional Name: (E,4S,5R)-5-[[2-(benzyloxycarbonylamino)acetyl]amino]-4-methyl-hex-2-enoic acid ethyl ester Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(C)C(C)NC(=O)CNC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)/C=C/[C@H](C)[C@@H](C)NC(=O)CNC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C19H26N2O5/c1-4-25-18(23)11-10-14(2)15(3)21-17(22)12-20-19(24)26-13-16-8-6-5-7-9-16/h5-11,14-15H,4,12-13H2,1-3H3,(H,20,24)(H,21,22)/b11-10+/t14-,15+/m0/s1