2-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-[3-(4-chlorophenoxy)-2-hydroxy-propyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[[3-(4-chlorophenoxy)-2-hydroxypropyl]thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-[3-(4-chlorophenoxy)-2-hydroxypropyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[[3-(4-chlorophenoxy)-2-hydroxy-propyl]thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C19H19ClN2O2S MolecularWeight: 374.88436

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(C(=N2)SCC(COC3=CC=C(C=C3)Cl)O)C#N

Isomeric SMILES

C1CCC2=C(C1)C=C(C(=N2)SCC(COC3=CC=C(C=C3)Cl)O)C#N

InChI

InChI=1S/C19H19ClN2O2S/c20-15-5-7-17(8-6-15)24-11-16(23)12-25-19-14(10-21)9-13-3-1-2-4-18(13)22-19/h5-9,16,23H,1-4,11-12H2