5-dodecylsulfanyl-2,3-dimethoxy-naphthalene-1,4-dione

Systemtic Name: 5-dodecylsulfanyl-2,3-dimethoxy-naphthalene-1,4-dione Openeye Name: 5-dodecylsulfanyl-2,3-dimethoxy-naphthalene-1,4-dione CAS Name: 5-(dodecylthio)-2,3-dimethoxynaphthalene-1,4-dione IUPAC Name: 5-dodecylsulfanyl-2,3-dimethoxynaphthalene-1,4-dione Traditional Name: 5-(laurylthio)-2,3-dimethoxy-1,4-naphthoquinone Formula: C24H34O4S MolecularWeight: 418.58936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1=CC=CC2=C1C(=O)C(=C(C2=O)OC)OC

Isomeric SMILES

CCCCCCCCCCCCSC1=CC=CC2=C1C(=O)C(=C(C2=O)OC)OC

InChI

InChI=1S/C24H34O4S/c1-4-5-6-7-8-9-10-11-12-13-17-29-19-16-14-15-18-20(19)22(26)24(28-3)23(27-2)21(18)25/h14-16H,4-13,17H2,1-3H3