5-(2-phenylsulfanylcyclobuten-1-yl)-1,3-benzodioxole

Systemtic Name: 5-(2-phenylsulfanylcyclobuten-1-yl)-1,3-benzodioxole Openeye Name: 5-(2-phenylsulfanylcyclobuten-1-yl)-1,3-benzodioxole CAS Name: 5-[2-(phenylthio)-1-cyclobutenyl]-1,3-benzodioxole IUPAC Name: 5-(2-phenylsulfanylcyclobuten-1-yl)-1,3-benzodioxole Traditional Name: 5-[2-(phenylthio)cyclobuten-1-yl]-1,3-benzodioxole Formula: C17H14O2S MolecularWeight: 282.35686

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C1C2=CC3=C(C=C2)OCO3)SC4=CC=CC=C4

Isomeric SMILES

C1CC(=C1C2=CC3=C(C=C2)OCO3)SC4=CC=CC=C4

InChI

InChI=1S/C17H14O2S/c1-2-4-13(5-3-1)20-17-9-7-14(17)12-6-8-15-16(10-12)19-11-18-15/h1-6,8,10H,7,9,11H2