[(1E)-3,7-dimethylocta-1,6-dienyl] 5-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]-4-oxidanylidene-pentanoate

Systemtic Name: [(1E)-3,7-dimethylocta-1,6-dienyl] 5-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]-4-oxidanylidene-pentanoate Openeye Name: [(1E)-3,7-dimethylocta-1,6-dienyl] 5-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]-4-oxo-pentanoate CAS Name: 5-[[(2S)-2-acetamido-1-oxo-3-phenylpropyl]amino]-4-oxopentanoic acid [(1E)-3,7-dimethylocta-1,6-dienyl] ester IUPAC Name: [(1E)-3,7-dimethylocta-1,6-dienyl] 5-[[(2S)-2-acetamido-3-phenylpropanoyl]amino]-4-oxopentanoate Traditional Name: 5-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]-4-keto-valeric acid [(1E)-3,7-dimethylocta-1,6-dienyl] ester Formula: C26H36N2O5 MolecularWeight: 456.57444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)C)C=COC(=O)CCC(=O)CNC(=O)C(CC1=CC=CC=C1)NC(=O)C

Isomeric SMILES

CC(CCC=C(C)C)/C=C/OC(=O)CCC(=O)CNC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C

InChI

InChI=1S/C26H36N2O5/c1-19(2)9-8-10-20(3)15-16-33-25(31)14-13-23(30)18-27-26(32)24(28-21(4)29)17-22-11-6-5-7-12-22/h5-7,9,11-12,15-16,20,24H,8,10,13-14,17-18H2,1-4H3,(H,27,32)(H,28,29)/b16-15+/t20?,24-/m0/s1