lithium 1-(cyanomethyl)-2-phenylsulfanyl-cyclopent-2-en-1-olate

Systemtic Name: lithium 1-(cyanomethyl)-2-phenylsulfanyl-cyclopent-2-en-1-olate Openeye Name: lithium 1-(cyanomethyl)-2-phenylsulfanyl-cyclopent-2-en-1-olate CAS Name: lithium 1-(cyanomethyl)-2-(phenylthio)-1-cyclopent-2-enolate IUPAC Name: lithium 1-(cyanomethyl)-2-phenylsulfanylcyclopent-2-en-1-olate Traditional Name: lithium 1-(cyanomethyl)-2-(phenylthio)cyclopent-2-en-1-olate Formula: C13H12LiNOS MolecularWeight: 237.24648

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].C1CC(C(=C1)SC2=CC=CC=C2)(CC#N)[O-]

Isomeric SMILES

[Li+].C1CC(C(=C1)SC2=CC=CC=C2)(CC#N)[O-]

InChI

InChI=1S/C13H12NOS.Li/c14-10-9-13(15)8-4-7-12(13)16-11-5-2-1-3-6-11;/h1-3,5-7H,4,8-9H2;/q-1;+1