2-[3-(4-bromophenyl)sulfanylphenyl]-4-methoxy-oxane

Systemtic Name: 2-[3-(4-bromophenyl)sulfanylphenyl]-4-methoxy-oxane Openeye Name: 2-[3-(4-bromophenyl)sulfanylphenyl]-4-methoxy-tetrahydropyran CAS Name: 2-[3-[(4-bromophenyl)thio]phenyl]-4-methoxyoxane IUPAC Name: 2-[3-(4-bromophenyl)sulfanylphenyl]-4-methoxyoxane Traditional Name: 2-[3-[(4-bromophenyl)thio]phenyl]-4-methoxy-tetrahydropyran Formula: C18H19BrO2S MolecularWeight: 379.31126

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCOC(C1)C2=CC(=CC=C2)SC3=CC=C(C=C3)Br

Isomeric SMILES

COC1CCOC(C1)C2=CC(=CC=C2)SC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H19BrO2S/c1-20-15-9-10-21-18(12-15)13-3-2-4-17(11-13)22-16-7-5-14(19)6-8-16/h2-8,11,15,18H,9-10,12H2,1H3