3,6-bis(propylsulfanyl)naphthalene-2-sulfonic acid

Systemtic Name: 3,6-bis(propylsulfanyl)naphthalene-2-sulfonic acid Openeye Name: 3,6-bis(propylsulfanyl)naphthalene-2-sulfonic acid CAS Name: 3,6-bis(propylthio)-2-naphthalenesulfonic acid IUPAC Name: 3,6-bis(propylsulfanyl)naphthalene-2-sulfonic acid Traditional Name: 3,6-bis(propylthio)naphthalene-2-sulfonic acid Formula: C16H20O3S3 MolecularWeight: 356.5232

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC2=CC(=C(C=C2C=C1)S(=O)(=O)O)SCCC

Isomeric SMILES

CCCSC1=CC2=CC(=C(C=C2C=C1)S(=O)(=O)O)SCCC

InChI

InChI=1S/C16H20O3S3/c1-3-7-20-14-6-5-12-11-16(22(17,18)19)15(21-8-4-2)10-13(12)9-14/h5-6,9-11H,3-4,7-8H2,1-2H3,(H,17,18,19)