[6-methylsulfanyl-4-(phenylcarbonyloxy)-2-phenylsulfanyl-3-propyl-naphthalen-1-yl] benzoate

Systemtic Name: [6-methylsulfanyl-4-(phenylcarbonyloxy)-2-phenylsulfanyl-3-propyl-naphthalen-1-yl] benzoate Openeye Name: (4-benzoyloxy-6-methylsulfanyl-2-phenylsulfanyl-3-propyl-1-naphthyl) benzoate CAS Name: benzoic acid [4-benzoyloxy-6-(methylthio)-2-(phenylthio)-3-propyl-1-naphthalenyl] ester IUPAC Name: (4-benzoyloxy-6-methylsulfanyl-2-phenylsulfanyl-3-propylnaphthalen-1-yl) benzoate Traditional Name: benzoic acid [4-benzoyloxy-6-(methylthio)-2-(phenylthio)-3-propyl-1-naphthyl] ester Formula: C34H28O4S2 MolecularWeight: 564.71372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(C=CC(=C2)SC)C(=C1SC3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

CCCC1=C(C2=C(C=CC(=C2)SC)C(=C1SC3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C34H28O4S2/c1-3-13-28-30(37-33(35)23-14-7-4-8-15-23)29-22-26(39-2)20-21-27(29)31(32(28)40-25-18-11-6-12-19-25)38-34(36)24-16-9-5-10-17-24/h4-12,14-22H,3,13H2,1-2H3