2-(4-dodecoxyphenyl)-2-oxidanylidene-ethanal hydrate

Systemtic Name: 2-(4-dodecoxyphenyl)-2-oxidanylidene-ethanal hydrate Openeye Name: 2-(4-dodecoxyphenyl)-2-oxo-acetaldehyde hydrate CAS Name: 2-(4-dodecoxyphenyl)-2-oxoacetaldehyde hydrate IUPAC Name: 2-(4-dodecoxyphenyl)-2-oxoacetaldehyde hydrate Traditional Name: 2-keto-2-(4-lauryloxyphenyl)acetaldehyde hydrate Formula: C20H32O4 MolecularWeight: 336.46568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)C=O.O

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)C=O.O

InChI

InChI=1S/C20H30O3.H2O/c1-2-3-4-5-6-7-8-9-10-11-16-23-19-14-12-18(13-15-19)20(22)17-21;/h12-15,17H,2-11,16H2,1H3;1H2