[2-(3,5-dimethylphenyl)-5-(2-methyloctan-2-yl)phenyl]methyl 2-morpholin-4-ylethanoate

Systemtic Name: [2-(3,5-dimethylphenyl)-5-(2-methyloctan-2-yl)phenyl]methyl 2-morpholin-4-ylethanoate Openeye Name: [5-(1,1-dimethylheptyl)-2-(3,5-dimethylphenyl)phenyl]methyl 2-morpholinoacetate CAS Name: 2-(4-morpholinyl)acetic acid [2-(3,5-dimethylphenyl)-5-(2-methyloctan-2-yl)phenyl]methyl ester IUPAC Name: [2-(3,5-dimethylphenyl)-5-(2-methyloctan-2-yl)phenyl]methyl 2-morpholin-4-ylacetate Traditional Name: 2-morpholinoacetic acid [5-(1,1-dimethylheptyl)-2-(3,5-dimethylphenyl)benzyl] ester Formula: C30H43NO3 MolecularWeight: 465.66732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2=CC(=CC(=C2)C)C)COC(=O)CN3CCOCC3

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2=CC(=CC(=C2)C)C)COC(=O)CN3CCOCC3

InChI

InChI=1S/C30H43NO3/c1-6-7-8-9-12-30(4,5)27-10-11-28(25-18-23(2)17-24(3)19-25)26(20-27)22-34-29(32)21-31-13-15-33-16-14-31/h10-11,17-20H,6-9,12-16,21-22H2,1-5H3