(2S)-3-[4-(2-tert-butyl-6-methyl-phenoxy)phenyl]-2-phenyl-propanoate

Systemtic Name: (2S)-3-[4-(2-tert-butyl-6-methyl-phenoxy)phenyl]-2-phenyl-propanoate Openeye Name: (2S)-3-[4-(2-tert-butyl-6-methyl-phenoxy)phenyl]-2-phenyl-propanoate CAS Name: (2S)-3-[4-(2-tert-butyl-6-methylphenoxy)phenyl]-2-phenylpropanoate IUPAC Name: (2S)-3-[4-(2-tert-butyl-6-methylphenoxy)phenyl]-2-phenylpropanoate Traditional Name: (2S)-3-[4-(2-tert-butyl-6-methyl-phenoxy)phenyl]-2-phenyl-propionate Formula: C26H27O3- MolecularWeight: 387.49078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)(C)C)OC2=CC=C(C=C2)CC(C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)(C)C)OC2=CC=C(C=C2)C[C@@H](C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C26H28O3/c1-18-9-8-12-23(26(2,3)4)24(18)29-21-15-13-19(14-16-21)17-22(25(27)28)20-10-6-5-7-11-20/h5-16,22H,17H2,1-4H3,(H,27,28)/p-1/t22-/m0/s1