diethyl 3-[(E)-1-methylsulfanyl-3,3-diphenyl-prop-1-enyl]cyclobutane-1,1-dicarboxylate

Systemtic Name: diethyl 3-[(E)-1-methylsulfanyl-3,3-diphenyl-prop-1-enyl]cyclobutane-1,1-dicarboxylate Openeye Name: diethyl 3-[(E)-1-methylsulfanyl-3,3-diphenyl-prop-1-enyl]cyclobutane-1,1-dicarboxylate CAS Name: 3-[(E)-1-(methylthio)-3,3-diphenylprop-1-enyl]cyclobutane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-[(E)-1-methylsulfanyl-3,3-diphenylprop-1-enyl]cyclobutane-1,1-dicarboxylate Traditional Name: 3-[(E)-1-(methylthio)-3,3-diphenyl-prop-1-enyl]cyclobutane-1,1-dicarboxylic acid diethyl ester Formula: C26H30O4S MolecularWeight: 438.579

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(C1)C(=CC(C2=CC=CC=C2)C3=CC=CC=C3)SC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC(C1)/C(=C\C(C2=CC=CC=C2)C3=CC=CC=C3)/SC)C(=O)OCC

InChI

InChI=1S/C26H30O4S/c1-4-29-24(27)26(25(28)30-5-2)17-21(18-26)23(31-3)16-22(19-12-8-6-9-13-19)20-14-10-7-11-15-20/h6-16,21-22H,4-5,17-18H2,1-3H3/b23-16+