[(2R)-1,4-bis[[(E)-3-phenylprop-2-enoyl]amino]butan-2-yl] (3S)-3-methyl-5-[[(1S)-1-naphthalen-1-ylethyl]amino]-3-oxidanyl-5-oxidanylidene-pentanoate

Systemtic Name: [(2R)-1,4-bis[[(E)-3-phenylprop-2-enoyl]amino]butan-2-yl] (3S)-3-methyl-5-[[(1S)-1-naphthalen-1-ylethyl]amino]-3-oxidanyl-5-oxidanylidene-pentanoate Openeye Name: [(1R)-3-[[(E)-3-phenylprop-2-enoyl]amino]-1-[[[(E)-3-phenylprop-2-enoyl]amino]methyl]propyl] (3S)-3-hydroxy-3-methyl-5-[[(1S)-1-(1-naphthyl)ethyl]amino]-5-oxo-pentanoate CAS Name: (3S)-3-hydroxy-3-methyl-5-[[(1S)-1-(1-naphthalenyl)ethyl]amino]-5-oxopentanoic acid [(2R)-1,4-bis[[(E)-1-oxo-3-phenylprop-2-enyl]amino]butan-2-yl] ester IUPAC Name: [(2R)-1,4-bis[[(E)-3-phenylprop-2-enoyl]amino]butan-2-yl] (3S)-3-hydroxy-3-methyl-5-[[(1S)-1-naphthalen-1-ylethyl]amino]-5-oxopentanoate Traditional Name: (3S)-3-hydroxy-5-keto-3-methyl-5-[[(1S)-1-(1-naphthyl)ethyl]amino]valeric acid [(1R)-3-[[(E)-3-phenylacryloyl]amino]-1-[[[(E)-3-phenylacryloyl]amino]methyl]propyl] ester Formula: C40H43N3O6 MolecularWeight: 661.78592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)CC(C)(CC(=O)OC(CCNC(=O)C=CC3=CC=CC=C3)CNC(=O)C=CC4=CC=CC=C4)O

Isomeric SMILES

C[C@@H](C1=CC=CC2=CC=CC=C21)NC(=O)C[C@@](C)(CC(=O)O[C@H](CCNC(=O)/C=C/C3=CC=CC=C3)CNC(=O)/C=C/C4=CC=CC=C4)O

InChI

InChI=1S/C40H43N3O6/c1-29(34-19-11-17-32-16-9-10-18-35(32)34)43-38(46)26-40(2,48)27-39(47)49-33(28-42-37(45)23-21-31-14-7-4-8-15-31)24-25-41-36(44)22-20-30-12-5-3-6-13-30/h3-23,29,33,48H,24-28H2,1-2H3,(H,41,44)(H,42,45)(H,43,46)/b22-20+,23-21+/t29-,33+,40-/m0/s1