2-methyl-2-[[2-methyl-4-[3-[3-methyl-4-(3,4,4-trimethyl-3-oxidanyl-pent-1-ynyl)phenyl]pentan-3-yl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 2-methyl-2-[[2-methyl-4-[3-[3-methyl-4-(3,4,4-trimethyl-3-oxidanyl-pent-1-ynyl)phenyl]pentan-3-yl]phenyl]carbonylamino]propanoic acid Openeye Name: 2-[[4-[1-ethyl-1-[4-(3-hydroxy-3,4,4-trimethyl-pent-1-ynyl)-3-methyl-phenyl]propyl]-2-methyl-benzoyl]amino]-2-methyl-propanoic acid CAS Name: 2-[[[4-[3-[4-(3-hydroxy-3,4,4-trimethylpent-1-ynyl)-3-methylphenyl]pentan-3-yl]-2-methylphenyl]-oxomethyl]amino]-2-methylpropanoic acid IUPAC Name: 2-[[4-[3-[4-(3-hydroxy-3,4,4-trimethylpent-1-ynyl)-3-methylphenyl]pentan-3-yl]-2-methylbenzoyl]amino]-2-methylpropanoic acid Traditional Name: 2-[[4-[1-ethyl-1-[4-(3-hydroxy-3,4,4-trimethyl-pent-1-ynyl)-3-methyl-phenyl]propyl]-2-methyl-benzoyl]amino]-2-methyl-propionic acid Formula: C32H43NO4 MolecularWeight: 505.68812

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=C(C=C1)C#CC(C)(C(C)(C)C)O)C)C2=CC(=C(C=C2)C(=O)NC(C)(C)C(=O)O)C

Isomeric SMILES

CCC(CC)(C1=CC(=C(C=C1)C#CC(C)(C(C)(C)C)O)C)C2=CC(=C(C=C2)C(=O)NC(C)(C)C(=O)O)C

InChI

InChI=1S/C32H43NO4/c1-11-32(12-2,24-14-13-23(21(3)19-24)17-18-31(10,37)29(5,6)7)25-15-16-26(22(4)20-25)27(34)33-30(8,9)28(35)36/h13-16,19-20,37H,11-12H2,1-10H3,(H,33,34)(H,35,36)