1-[(4R,6R)-2,2-dimethyl-6-tridecyl-1,3-dioxan-4-yl]-4-(4-hydroxyphenyl)butan-2-one

Systemtic Name: 1-[(4R,6R)-2,2-dimethyl-6-tridecyl-1,3-dioxan-4-yl]-4-(4-hydroxyphenyl)butan-2-one Openeye Name: 1-[(4R,6R)-2,2-dimethyl-6-tridecyl-1,3-dioxan-4-yl]-4-(4-hydroxyphenyl)butan-2-one CAS Name: 1-[(4R,6R)-2,2-dimethyl-6-tridecyl-1,3-dioxan-4-yl]-4-(4-hydroxyphenyl)-2-butanone IUPAC Name: 1-[(4R,6R)-2,2-dimethyl-6-tridecyl-1,3-dioxan-4-yl]-4-(4-hydroxyphenyl)butan-2-one Traditional Name: 1-[(4R,6R)-2,2-dimethyl-6-tridecyl-1,3-dioxan-4-yl]-4-(4-hydroxyphenyl)butan-2-one Formula: C29H48O4 MolecularWeight: 460.68902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1CC(OC(O1)(C)C)CC(=O)CCC2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCCCCCC[C@@H]1C[C@@H](OC(O1)(C)C)CC(=O)CCC2=CC=C(C=C2)O

InChI

InChI=1S/C29H48O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-27-23-28(33-29(2,3)32-27)22-26(31)21-18-24-16-19-25(30)20-17-24/h16-17,19-20,27-28,30H,4-15,18,21-23H2,1-3H3/t27-,28+/m1/s1