(2S)-2-(3,4-dimethoxyphenyl)-5-oxidanylidene-2-prop-2-enyl-hexanal

Systemtic Name: (2S)-2-(3,4-dimethoxyphenyl)-5-oxidanylidene-2-prop-2-enyl-hexanal Openeye Name: (2S)-2-allyl-2-(3,4-dimethoxyphenyl)-5-oxo-hexanal CAS Name: (2S)-2-(3,4-dimethoxyphenyl)-5-oxo-2-prop-2-enylhexanal IUPAC Name: (2S)-2-(3,4-dimethoxyphenyl)-5-oxo-2-prop-2-enylhexanal Traditional Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(3-ketobutyl)pent-4-enal Formula: C17H22O4 MolecularWeight: 290.35418

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(CC=C)(C=O)C1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CC(=O)CC[C@@](CC=C)(C=O)C1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C17H22O4/c1-5-9-17(12-18,10-8-13(2)19)14-6-7-15(20-3)16(11-14)21-4/h5-7,11-12H,1,8-10H2,2-4H3/t17-/m0/s1