3-(4-methoxyphenyl)pyrrolidine-2-carbothioate

Systemtic Name: 3-(4-methoxyphenyl)pyrrolidine-2-carbothioate Openeye Name: 3-(4-methoxyphenyl)pyrrolidine-2-carbothioate CAS Name: 3-(4-methoxyphenyl)-2-pyrrolidinecarbothioate IUPAC Name: 3-(4-methoxyphenyl)pyrrolidine-2-carbothioate Traditional Name: 3-(4-methoxyphenyl)pyrrolidine-2-carbothioate Formula: C12H14NO2S- MolecularWeight: 236.31006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCNC2C(=S)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2CCNC2C(=S)[O-]

InChI

InChI=1S/C12H15NO2S/c1-15-9-4-2-8(3-5-9)10-6-7-13-11(10)12(14)16/h2-5,10-11,13H,6-7H2,1H3,(H,14,16)/p-1