5-[2,3-bis(2-phenylpropan-2-yl)phenoxy]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[2,3-bis(2-phenylpropan-2-yl)phenoxy]-5-oxidanylidene-pentanoate Openeye Name: 5-[2,3-bis(1-methyl-1-phenyl-ethyl)phenoxy]-5-oxo-pentanoate CAS Name: 5-[2,3-bis(2-phenylpropan-2-yl)phenoxy]-5-oxopentanoate IUPAC Name: 5-[2,3-bis(2-phenylpropan-2-yl)phenoxy]-5-oxopentanoate Traditional Name: 5-(2,3-dicumylphenoxy)-5-keto-valerate Formula: C29H31O4- MolecularWeight: 443.55404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=C(C(=CC=C2)OC(=O)CCCC(=O)[O-])C(C)(C)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=C(C(=CC=C2)OC(=O)CCCC(=O)[O-])C(C)(C)C3=CC=CC=C3

InChI

InChI=1S/C29H32O4/c1-28(2,21-13-7-5-8-14-21)23-17-11-18-24(33-26(32)20-12-19-25(30)31)27(23)29(3,4)22-15-9-6-10-16-22/h5-11,13-18H,12,19-20H2,1-4H3,(H,30,31)/p-1