(2S)-2-[but-3-enyl-[2-(phenylmethoxycarbonylamino)ethanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[but-3-enyl-[2-(phenylmethoxycarbonylamino)ethanoyl]amino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[2-(benzyloxycarbonylamino)acetyl]-but-3-enyl-amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[but-3-enyl-[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[but-3-enyl-[2-(phenylmethoxycarbonylamino)acetyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[2-(benzyloxycarbonylamino)acetyl]-but-3-enyl-amino]-3-phenyl-propionic acid Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCN(C(CC1=CC=CC=C1)C(=O)O)C(=O)CNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C=CCCN([C@@H](CC1=CC=CC=C1)C(=O)O)C(=O)CNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H26N2O5/c1-2-3-14-25(20(22(27)28)15-18-10-6-4-7-11-18)21(26)16-24-23(29)30-17-19-12-8-5-9-13-19/h2,4-13,20H,1,3,14-17H2,(H,24,29)(H,27,28)/t20-/m0/s1