[(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[2-(2-hydroxyethyloxy)ethylamino]-2-oxidanylidene-ethyl]pent-4-enoyl]amino]propyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hex-5-enoate

Systemtic Name: [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[2-(2-hydroxyethyloxy)ethylamino]-2-oxidanylidene-ethyl]pent-4-enoyl]amino]propyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hex-5-enoate Openeye Name: [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[2-(2-hydroxyethoxy)ethylamino]-2-oxo-ethyl]pent-4-enoyl]amino]propyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hex-5-enoate CAS Name: (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-5-hexenoic acid [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[2-(2-hydroxyethoxy)ethylamino]-2-oxoethyl]-1-oxopent-4-enyl]amino]propyl] ester IUPAC Name: [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[2-(2-hydroxyethoxy)ethylamino]-2-oxoethyl]pent-4-enoyl]amino]propyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hex-5-enoate Traditional Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hex-5-enoic acid [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[2-(2-hydroxyethoxy)ethylamino]-2-keto-ethyl]pent-4-enoyl]amino]propyl] ester Formula: C41H55N3O8 MolecularWeight: 717.8907

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(C(=O)OCC(CC1CCCCC1)NC(=O)C(CC=C)CC(=O)NCCOCCO)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

C=CCC[C@@H](C(=O)OC[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)CC(=O)NCCOCCO)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C41H55N3O8/c1-3-5-20-37(44-41(49)52-28-36-34-18-11-9-16-32(34)33-17-10-12-19-35(33)36)40(48)51-27-31(25-29-14-7-6-8-15-29)43-39(47)30(13-4-2)26-38(46)42-21-23-50-24-22-45/h3-4,9-12,16-19,29-31,36-37,45H,1-2,5-8,13-15,20-28H2,(H,42,46)(H,43,47)(H,44,49)/t30-,31+,37+/m1/s1