(3E)-3-[(4-methylsulfanylphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate

Systemtic Name: (3E)-3-[(4-methylsulfanylphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Openeye Name: (3E)-3-[(4-methylsulfanylphenyl)methylene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate CAS Name: (3E)-3-[[4-(methylthio)phenyl]methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate IUPAC Name: (3E)-3-[(4-methylsulfanylphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Traditional Name: (3E)-3-[4-(methylthio)benzylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Formula: C21H16NO2S- MolecularWeight: 346.42224

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C2CCC3=C(C4=CC=CC=C4N=C23)C(=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/2\CCC3=C(C4=CC=CC=C4N=C23)C(=O)[O-]

InChI

InChI=1S/C21H17NO2S/c1-25-15-9-6-13(7-10-15)12-14-8-11-17-19(21(23)24)16-4-2-3-5-18(16)22-20(14)17/h2-7,9-10,12H,8,11H2,1H3,(H,23,24)/p-1/b14-12+