2-butyl-2-[(4-hydroxyphenyl)methyl]propanedial

Systemtic Name: 2-butyl-2-[(4-hydroxyphenyl)methyl]propanedial Openeye Name: 2-butyl-2-[(4-hydroxyphenyl)methyl]propanedial CAS Name: 2-butyl-2-[(4-hydroxyphenyl)methyl]propanedial IUPAC Name: 2-butyl-2-[(4-hydroxyphenyl)methyl]propanedial Traditional Name: 2-butyl-2-(4-hydroxybenzyl)malonaldehyde Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=CC=C(C=C1)O)(C=O)C=O

Isomeric SMILES

CCCCC(CC1=CC=C(C=C1)O)(C=O)C=O

InChI

InChI=1S/C14H18O3/c1-2-3-8-14(10-15,11-16)9-12-4-6-13(17)7-5-12/h4-7,10-11,17H,2-3,8-9H2,1H3