diethyl 2-[(Z)-3-phenylselanyl-2-phenylsulfanyl-prop-2-enyl]-2-prop-2-enyl-propanedioate

Systemtic Name: diethyl 2-[(Z)-3-phenylselanyl-2-phenylsulfanyl-prop-2-enyl]-2-prop-2-enyl-propanedioate Openeye Name: diethyl 2-allyl-2-[(Z)-3-phenylselanyl-2-phenylsulfanyl-allyl]propanedioate CAS Name: 2-[(Z)-3-(phenylseleno)-2-(phenylthio)prop-2-enyl]-2-prop-2-enylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[(Z)-3-phenylselanyl-2-phenylsulfanylprop-2-enyl]-2-prop-2-enylpropanedioate Traditional Name: 2-allyl-2-[(Z)-3-(phenylseleno)-2-(phenylthio)allyl]malonic acid diethyl ester Formula: C25H28O4SSe MolecularWeight: 503.51242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=C)(CC(=C[Se]C1=CC=CC=C1)SC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC=C)(C/C(=C/[Se]C1=CC=CC=C1)/SC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C25H28O4SSe/c1-4-17-25(23(26)28-5-2,24(27)29-6-3)18-21(30-20-13-9-7-10-14-20)19-31-22-15-11-8-12-16-22/h4,7-16,19H,1,5-6,17-18H2,2-3H3/b21-19-