2,4-dimethylpentan-3-yl 3-oxidanylidene-6-phenyl-2-(phenyl-$l^{3}-iodanylidene)hexanoate

Systemtic Name: 2,4-dimethylpentan-3-yl 3-oxidanylidene-6-phenyl-2-(phenyl-$l^{3}-iodanylidene)hexanoate Openeye Name: (1-isopropyl-2-methyl-propyl) 3-oxo-6-phenyl-2-(phenyl-$l^{3}-iodanylidene)hexanoate CAS Name: 3-oxo-6-phenyl-2-(phenyl-$l^{3}-iodanylidene)hexanoic acid 2,4-dimethylpentan-3-yl ester IUPAC Name: 2,4-dimethylpentan-3-yl 3-oxo-6-phenyl-2-(phenyl-$l^{3}-iodanylidene)hexanoate Traditional Name: 3-keto-6-phenyl-2-phenyliodinanylidene-hexanoic acid (1-isopropyl-2-methyl-propyl) ester Formula: C25H31IO3 MolecularWeight: 506.41631

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C)OC(=O)C(=IC1=CC=CC=C1)C(=O)CCCC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(C)C)OC(=O)C(=IC1=CC=CC=C1)C(=O)CCCC2=CC=CC=C2

InChI

InChI=1S/C25H31IO3/c1-18(2)24(19(3)4)29-25(28)23(26-21-15-9-6-10-16-21)22(27)17-11-14-20-12-7-5-8-13-20/h5-10,12-13,15-16,18-19,24H,11,14,17H2,1-4H3