1-tert-butyl-4-[4-(4-chloranylphenoxy)but-2-ynylsulfanyl]benzene

Systemtic Name: 1-tert-butyl-4-[4-(4-chloranylphenoxy)but-2-ynylsulfanyl]benzene Openeye Name: 1-tert-butyl-4-[4-(4-chlorophenoxy)but-2-ynylsulfanyl]benzene CAS Name: 1-tert-butyl-4-[4-(4-chlorophenoxy)but-2-ynylthio]benzene IUPAC Name: 1-tert-butyl-4-[4-(4-chlorophenoxy)but-2-ynylsulfanyl]benzene Traditional Name: 1-tert-butyl-4-[4-(4-chlorophenoxy)but-2-ynylthio]benzene Formula: C20H21ClOS MolecularWeight: 344.89814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC#CCOC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC#CCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H21ClOS/c1-20(2,3)16-6-12-19(13-7-16)23-15-5-4-14-22-18-10-8-17(21)9-11-18/h6-13H,14-15H2,1-3H3