3-(1-naphthalen-1-ylsulfanylpropyl)-4-(3-phenylsulfanylpropyl)phthalate

Systemtic Name: 3-(1-naphthalen-1-ylsulfanylpropyl)-4-(3-phenylsulfanylpropyl)phthalate Openeye Name: 3-[1-(1-naphthylsulfanyl)propyl]-4-(3-phenylsulfanylpropyl)phthalate CAS Name: 3-[1-(1-naphthalenylthio)propyl]-4-[3-(phenylthio)propyl]phthalate IUPAC Name: 3-(1-naphthalen-1-ylsulfanylpropyl)-4-(3-phenylsulfanylpropyl)phthalate Traditional Name: 3-[1-(1-naphthylthio)propyl]-4-[3-(phenylthio)propyl]phthalate Formula: C30H26O4S2-2 MolecularWeight: 514.65504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1C(=O)[O-])C(=O)[O-])CCCSC2=CC=CC=C2)SC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCC(C1=C(C=CC(=C1C(=O)[O-])C(=O)[O-])CCCSC2=CC=CC=C2)SC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C30H28O4S2/c1-2-25(36-26-16-8-11-20-10-6-7-15-23(20)26)27-21(12-9-19-35-22-13-4-3-5-14-22)17-18-24(29(31)32)28(27)30(33)34/h3-8,10-11,13-18,25H,2,9,12,19H2,1H3,(H,31,32)(H,33,34)/p-2