2-[[4-[3-[4-(3,3-dimethyl-2-oxidanylidene-butoxy)-3-methyl-phenyl]pentan-3-yl]-2-methyl-phenyl]methyl-ethanoyl-amino]ethanoic acid

Systemtic Name: 2-[[4-[3-[4-(3,3-dimethyl-2-oxidanylidene-butoxy)-3-methyl-phenyl]pentan-3-yl]-2-methyl-phenyl]methyl-ethanoyl-amino]ethanoic acid Openeye Name: 2-[acetyl-[[4-[1-[4-(3,3-dimethyl-2-oxo-butoxy)-3-methyl-phenyl]-1-ethyl-propyl]-2-methyl-phenyl]methyl]amino]acetic acid CAS Name: 2-[acetyl-[[4-[3-[4-(3,3-dimethyl-2-oxobutoxy)-3-methylphenyl]pentan-3-yl]-2-methylphenyl]methyl]amino]acetic acid IUPAC Name: 2-[acetyl-[[4-[3-[4-(3,3-dimethyl-2-oxobutoxy)-3-methylphenyl]pentan-3-yl]-2-methylphenyl]methyl]amino]acetic acid Traditional Name: 2-[acetyl-[4-[1-ethyl-1-[4-(2-keto-3,3-dimethyl-butoxy)-3-methyl-phenyl]propyl]-2-methyl-benzyl]amino]acetic acid Formula: C30H41NO5 MolecularWeight: 495.65024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=C(C=C1)CN(CC(=O)O)C(=O)C)C)C2=CC(=C(C=C2)OCC(=O)C(C)(C)C)C

Isomeric SMILES

CCC(CC)(C1=CC(=C(C=C1)CN(CC(=O)O)C(=O)C)C)C2=CC(=C(C=C2)OCC(=O)C(C)(C)C)C

InChI

InChI=1S/C30H41NO5/c1-9-30(10-2,25-13-14-26(21(4)16-25)36-19-27(33)29(6,7)8)24-12-11-23(20(3)15-24)17-31(22(5)32)18-28(34)35/h11-16H,9-10,17-19H2,1-8H3,(H,34,35)