[(2S)-3-cyclohexyl-2-[[(2R)-2-[2-oxidanylidene-2-[[(2S)-1-oxidanylpropan-2-yl]amino]ethyl]pent-4-enoyl]amino]propyl] hept-6-enoate

Systemtic Name: [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-oxidanylidene-2-[[(2S)-1-oxidanylpropan-2-yl]amino]ethyl]pent-4-enoyl]amino]propyl] hept-6-enoate Openeye Name: [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[[(1S)-2-hydroxy-1-methyl-ethyl]amino]-2-oxo-ethyl]pent-4-enoyl]amino]propyl] hept-6-enoate CAS Name: 6-heptenoic acid [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[[(2S)-1-hydroxypropan-2-yl]amino]-2-oxoethyl]-1-oxopent-4-enyl]amino]propyl] ester IUPAC Name: [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[[(2S)-1-hydroxypropan-2-yl]amino]-2-oxoethyl]pent-4-enoyl]amino]propyl] hept-6-enoate Traditional Name: hept-6-enoic acid [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[[(1S)-2-hydroxy-1-methyl-ethyl]amino]-2-keto-ethyl]pent-4-enoyl]amino]propyl] ester Formula: C26H44N2O5 MolecularWeight: 464.63796

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)NC(=O)CC(CC=C)C(=O)NC(CC1CCCCC1)COC(=O)CCCCC=C

Isomeric SMILES

C[C@@H](CO)NC(=O)C[C@@H](CC=C)C(=O)N[C@@H](CC1CCCCC1)COC(=O)CCCCC=C

InChI

InChI=1S/C26H44N2O5/c1-4-6-7-11-15-25(31)33-19-23(16-21-13-9-8-10-14-21)28-26(32)22(12-5-2)17-24(30)27-20(3)18-29/h4-5,20-23,29H,1-2,6-19H2,3H3,(H,27,30)(H,28,32)/t20-,22+,23-/m0/s1