(E)-5-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]pent-3-enoic acid

Systemtic Name: (E)-5-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]pent-3-enoic acid Openeye Name: (E)-5-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]pent-3-enoic acid CAS Name: (E)-5-[[1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]amino]-3-pentenoic acid IUPAC Name: (E)-5-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]pent-3-enoic acid Traditional Name: (E)-5-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]pent-3-enoic acid Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCC=CCC(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC/C=C/CC(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H24N2O5/c25-20(26)13-7-8-14-23-21(27)19(15-17-9-3-1-4-10-17)24-22(28)29-16-18-11-5-2-6-12-18/h1-12,19H,13-16H2,(H,23,27)(H,24,28)(H,25,26)/b8-7+