3-[(E)-3-(3-phenyloxiran-2-yl)prop-2-enyl]-3-phenylsulfanyl-pentane-2,4-dione

Systemtic Name: 3-[(E)-3-(3-phenyloxiran-2-yl)prop-2-enyl]-3-phenylsulfanyl-pentane-2,4-dione Openeye Name: 3-[(E)-3-(3-phenyloxiran-2-yl)allyl]-3-phenylsulfanyl-pentane-2,4-dione CAS Name: 3-[(E)-3-(3-phenyl-2-oxiranyl)prop-2-enyl]-3-(phenylthio)pentane-2,4-dione IUPAC Name: 3-[(E)-3-(3-phenyloxiran-2-yl)prop-2-enyl]-3-phenylsulfanylpentane-2,4-dione Traditional Name: 3-[(E)-3-(3-phenyloxiran-2-yl)allyl]-3-(phenylthio)pentane-2,4-dione Formula: C22H22O3S MolecularWeight: 366.47328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC=CC1C(O1)C2=CC=CC=C2)(C(=O)C)SC3=CC=CC=C3

Isomeric SMILES

CC(=O)C(C/C=C/C1C(O1)C2=CC=CC=C2)(C(=O)C)SC3=CC=CC=C3

InChI

InChI=1S/C22H22O3S/c1-16(23)22(17(2)24,26-19-12-7-4-8-13-19)15-9-14-20-21(25-20)18-10-5-3-6-11-18/h3-14,20-21H,15H2,1-2H3/b14-9+