(E)-3-(3-nonoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(3-nonoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(3-nonoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one CAS Name: (E)-3-(3-nonoxyphenyl)-1-[4-(propylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(3-nonoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3-nonoxyphenyl)-1-[4-(propylthio)phenyl]prop-2-en-1-one Formula: C27H36O2S MolecularWeight: 424.63854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=CC(=C1)C=CC(=O)C2=CC=C(C=C2)SCCC

Isomeric SMILES

CCCCCCCCCOC1=CC=CC(=C1)/C=C/C(=O)C2=CC=C(C=C2)SCCC

InChI

InChI=1S/C27H36O2S/c1-3-5-6-7-8-9-10-20-29-25-13-11-12-23(22-25)14-19-27(28)24-15-17-26(18-16-24)30-21-4-2/h11-19,22H,3-10,20-21H2,1-2H3/b19-14+