4-cyclohexyl-3-[[4-methyl-2-[[2-(2-oxidanylidenepyrrolidin-1-yl)-3-phenyl-propanoyl]amino]pentanoyl]amino]-2-oxidanyl-butanoic acid

Systemtic Name: 4-cyclohexyl-3-[[4-methyl-2-[[2-(2-oxidanylidenepyrrolidin-1-yl)-3-phenyl-propanoyl]amino]pentanoyl]amino]-2-oxidanyl-butanoic acid Openeye Name: 4-cyclohexyl-2-hydroxy-3-[[4-methyl-2-[[2-(2-oxopyrrolidin-1-yl)-3-phenyl-propanoyl]amino]pentanoyl]amino]butanoic acid CAS Name: 4-cyclohexyl-2-hydroxy-3-[[4-methyl-1-oxo-2-[[1-oxo-2-(2-oxo-1-pyrrolidinyl)-3-phenylpropyl]amino]pentyl]amino]butanoic acid IUPAC Name: 4-cyclohexyl-2-hydroxy-3-[[4-methyl-2-[[2-(2-oxopyrrolidin-1-yl)-3-phenylpropanoyl]amino]pentanoyl]amino]butanoic acid Traditional Name: 4-cyclohexyl-2-hydroxy-3-[[2-[[2-(2-ketopyrrolidino)-3-phenyl-propanoyl]amino]-4-methyl-pentanoyl]amino]butyric acid Formula: C29H43N3O6 MolecularWeight: 529.66822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1CCCCC1)C(C(=O)O)O)NC(=O)C(CC2=CC=CC=C2)N3CCCC3=O

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1CCCCC1)C(C(=O)O)O)NC(=O)C(CC2=CC=CC=C2)N3CCCC3=O

InChI

InChI=1S/C29H43N3O6/c1-19(2)16-23(27(35)30-22(26(34)29(37)38)17-20-10-5-3-6-11-20)31-28(36)24(32-15-9-14-25(32)33)18-21-12-7-4-8-13-21/h4,7-8,12-13,19-20,22-24,26,34H,3,5-6,9-11,14-18H2,1-2H3,(H,30,35)(H,31,36)(H,37,38)