(E)-3-(4-tert-butylsulfanyl-4-decoxy-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(4-tert-butylsulfanyl-4-decoxy-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(4-tert-butylsulfanyl-4-decoxy-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[4-(tert-butylthio)-4-decoxy-1-cyclohexa-2,5-dienyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(4-tert-butylsulfanyl-4-decoxycyclohexa-2,5-dien-1-yl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[4-(tert-butylthio)-4-decoxy-cyclohexa-2,5-dien-1-yl]-1-phenyl-prop-2-en-1-one Formula: C29H42O2S MolecularWeight: 454.70758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1(C=CC(C=C1)C=CC(=O)C2=CC=CC=C2)SC(C)(C)C

Isomeric SMILES

CCCCCCCCCCOC1(C=CC(C=C1)/C=C/C(=O)C2=CC=CC=C2)SC(C)(C)C

InChI

InChI=1S/C29H42O2S/c1-5-6-7-8-9-10-11-15-24-31-29(32-28(2,3)4)22-20-25(21-23-29)18-19-27(30)26-16-13-12-14-17-26/h12-14,16-23,25H,5-11,15,24H2,1-4H3/b19-18+