2-methyl-3-(2-oxidanylpropylsulfanyl)naphthalene-1,4-dione

Systemtic Name: 2-methyl-3-(2-oxidanylpropylsulfanyl)naphthalene-1,4-dione Openeye Name: 2-(2-hydroxypropylsulfanyl)-3-methyl-naphthalene-1,4-dione CAS Name: 2-(2-hydroxypropylthio)-3-methylnaphthalene-1,4-dione IUPAC Name: 2-(2-hydroxypropylsulfanyl)-3-methylnaphthalene-1,4-dione Traditional Name: 2-(2-hydroxypropylthio)-3-methyl-1,4-naphthoquinone Formula: C14H14O3S MolecularWeight: 262.32416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC=CC=C2C1=O)SCC(C)O

Isomeric SMILES

CC1=C(C(=O)C2=CC=CC=C2C1=O)SCC(C)O

InChI

InChI=1S/C14H14O3S/c1-8(15)7-18-14-9(2)12(16)10-5-3-4-6-11(10)13(14)17/h3-6,8,15H,7H2,1-2H3