2,3-diethyl-3-(4-ethylsulfanylphenoxy)cyclohexa-1,5-diene-1,4-dicarboxylate

Systemtic Name: 2,3-diethyl-3-(4-ethylsulfanylphenoxy)cyclohexa-1,5-diene-1,4-dicarboxylate Openeye Name: 2,3-diethyl-3-(4-ethylsulfanylphenoxy)cyclohexa-1,5-diene-1,4-dicarboxylate CAS Name: 2,3-diethyl-3-[4-(ethylthio)phenoxy]cyclohexa-1,5-diene-1,4-dicarboxylate IUPAC Name: 2,3-diethyl-3-(4-ethylsulfanylphenoxy)cyclohexa-1,5-diene-1,4-dicarboxylate Traditional Name: 2,3-diethyl-3-[4-(ethylthio)phenoxy]cyclohexa-1,5-diene-1,4-dicarboxylate Formula: C20H22O5S-2 MolecularWeight: 374.45068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(C1(CC)OC2=CC=C(C=C2)SCC)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCC1=C(C=CC(C1(CC)OC2=CC=C(C=C2)SCC)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C20H24O5S/c1-4-16-15(18(21)22)11-12-17(19(23)24)20(16,5-2)25-13-7-9-14(10-8-13)26-6-3/h7-12,17H,4-6H2,1-3H3,(H,21,22)(H,23,24)/p-2