(E)-2-butyl-2-[(4-methylphenyl)sulfonylmethyl]hex-4-enal

Systemtic Name: (E)-2-butyl-2-[(4-methylphenyl)sulfonylmethyl]hex-4-enal Openeye Name: (E)-2-butyl-2-(p-tolylsulfonylmethyl)hex-4-enal CAS Name: (E)-2-butyl-2-[(4-methylphenyl)sulfonylmethyl]-4-hexenal IUPAC Name: (E)-2-butyl-2-[(4-methylphenyl)sulfonylmethyl]hex-4-enal Traditional Name: (E)-2-butyl-2-(tosylmethyl)hex-4-enal Formula: C18H26O3S MolecularWeight: 322.46224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC(C/C=C/C)(CS(=O)(=O)C1=CC=C(C=C1)C)C=O

InChI

InChI=1S/C18H26O3S/c1-4-6-12-18(14-19,13-7-5-2)15-22(20,21)17-10-8-16(3)9-11-17/h4,6,8-11,14H,5,7,12-13,15H2,1-3H3/b6-4+