(E)-3-[4-[butyl(4-oxidanylbutyl)amino]phenyl]prop-2-enal

Systemtic Name: (E)-3-[4-[butyl(4-oxidanylbutyl)amino]phenyl]prop-2-enal Openeye Name: (E)-3-[4-[butyl(4-hydroxybutyl)amino]phenyl]prop-2-enal CAS Name: (E)-3-[4-[butyl(4-hydroxybutyl)amino]phenyl]-2-propenal IUPAC Name: (E)-3-[4-[butyl(4-hydroxybutyl)amino]phenyl]prop-2-enal Traditional Name: (E)-3-[4-[butyl(4-hydroxybutyl)amino]phenyl]acrolein Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCCO)C1=CC=C(C=C1)C=CC=O

Isomeric SMILES

CCCCN(CCCCO)C1=CC=C(C=C1)/C=C/C=O

InChI

InChI=1S/C17H25NO2/c1-2-3-12-18(13-4-5-14-19)17-10-8-16(9-11-17)7-6-15-20/h6-11,15,19H,2-5,12-14H2,1H3/b7-6+