4-[2,4-di(propan-2-yl)phenyl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2,4-di(propan-2-yl)phenyl]-4-oxidanylidene-butanoate Openeye Name: 4-(2,4-diisopropylphenyl)-4-oxo-butanoate CAS Name: 4-[2,4-di(propan-2-yl)phenyl]-4-oxobutanoate IUPAC Name: 4-[2,4-di(propan-2-yl)phenyl]-4-oxobutanoate Traditional Name: 4-(2,4-diisopropylphenyl)-4-keto-butyrate Formula: C16H21O3- MolecularWeight: 261.33614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)C(=O)CCC(=O)[O-])C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)C(=O)CCC(=O)[O-])C(C)C

InChI

InChI=1S/C16H22O3/c1-10(2)12-5-6-13(14(9-12)11(3)4)15(17)7-8-16(18)19/h5-6,9-11H,7-8H2,1-4H3,(H,18,19)/p-1