(2S)-3-methyl-2-[4-(2-phenylpropan-2-yl)phenoxy]butanoate

Systemtic Name: (2S)-3-methyl-2-[4-(2-phenylpropan-2-yl)phenoxy]butanoate Openeye Name: (2S)-3-methyl-2-[4-(1-methyl-1-phenyl-ethyl)phenoxy]butanoate CAS Name: (2S)-3-methyl-2-[4-(2-phenylpropan-2-yl)phenoxy]butanoate IUPAC Name: (2S)-3-methyl-2-[4-(2-phenylpropan-2-yl)phenoxy]butanoate Traditional Name: (2S)-2-(4-cumylphenoxy)-3-methyl-butyrate Formula: C20H23O3- MolecularWeight: 311.39482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])OC1=CC=C(C=C1)C(C)(C)C2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])OC1=CC=C(C=C1)C(C)(C)C2=CC=CC=C2

InChI

InChI=1S/C20H24O3/c1-14(2)18(19(21)22)23-17-12-10-16(11-13-17)20(3,4)15-8-6-5-7-9-15/h5-14,18H,1-4H3,(H,21,22)/p-1/t18-/m0/s1