2-[[4-[3-[4-[(E)-3-ethyl-4,4-dimethyl-3-oxidanyl-pent-1-enyl]-3-methyl-phenyl]pentan-3-yl]-2-methyl-phenyl]carbonylamino]-2-methyl-propanoic acid

Systemtic Name: 2-[[4-[3-[4-[(E)-3-ethyl-4,4-dimethyl-3-oxidanyl-pent-1-enyl]-3-methyl-phenyl]pentan-3-yl]-2-methyl-phenyl]carbonylamino]-2-methyl-propanoic acid Openeye Name: 2-[[4-[1-ethyl-1-[4-[(E)-3-ethyl-3-hydroxy-4,4-dimethyl-pent-1-enyl]-3-methyl-phenyl]propyl]-2-methyl-benzoyl]amino]-2-methyl-propanoic acid CAS Name: 2-[[[4-[3-[4-[(E)-3-ethyl-3-hydroxy-4,4-dimethylpent-1-enyl]-3-methylphenyl]pentan-3-yl]-2-methylphenyl]-oxomethyl]amino]-2-methylpropanoic acid IUPAC Name: 2-[[4-[3-[4-[(E)-3-ethyl-3-hydroxy-4,4-dimethylpent-1-enyl]-3-methylphenyl]pentan-3-yl]-2-methylbenzoyl]amino]-2-methylpropanoic acid Traditional Name: 2-[[4-[1-ethyl-1-[4-[(E)-3-ethyl-3-hydroxy-4,4-dimethyl-pent-1-enyl]-3-methyl-phenyl]propyl]-2-methyl-benzoyl]amino]-2-methyl-propionic acid Formula: C33H47NO4 MolecularWeight: 521.73058

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C33H47NO4/c1-11-32(12-2,26-16-17-27(23(5)21-26)28(35)34-31(9,10)29(36)37)25-15-14-24(22(4)20-25)18-19-33(38,13-3)30(6,7)8/h14-21,38H,11-13H2,1-10H3,(H,34,35)(H,36,37)/b19-18+