tert-butyl 4-[3-methyl-2-oxidanylidene-3-[4-(3-oxidanylpropyl)phenoxy]butoxy]benzoate

Systemtic Name: tert-butyl 4-[3-methyl-2-oxidanylidene-3-[4-(3-oxidanylpropyl)phenoxy]butoxy]benzoate Openeye Name: tert-butyl 4-[3-[4-(3-hydroxypropyl)phenoxy]-3-methyl-2-oxo-butoxy]benzoate CAS Name: 4-[3-[4-(3-hydroxypropyl)phenoxy]-3-methyl-2-oxobutoxy]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[4-(3-hydroxypropyl)phenoxy]-3-methyl-2-oxobutoxy]benzoate Traditional Name: 4-[3-[4-(3-hydroxypropyl)phenoxy]-2-keto-3-methyl-butoxy]benzoic acid tert-butyl ester Formula: C25H32O6 MolecularWeight: 428.51798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)OCC(=O)C(C)(C)OC2=CC=C(C=C2)CCCO

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)OCC(=O)C(C)(C)OC2=CC=C(C=C2)CCCO

InChI

InChI=1S/C25H32O6/c1-24(2,3)31-23(28)19-10-14-20(15-11-19)29-17-22(27)25(4,5)30-21-12-8-18(9-13-21)7-6-16-26/h8-15,26H,6-7,16-17H2,1-5H3