10-[(1E,5Z)-cycloocta-1,5-dien-1-yl]phenoxathiin-10-ium

Systemtic Name: 10-[(1E,5Z)-cycloocta-1,5-dien-1-yl]phenoxathiin-10-ium Openeye Name: 10-[(1E,5Z)-cycloocta-1,5-dien-1-yl]phenoxathiin-10-ium CAS Name: 10-[(1E,5Z)-1-cycloocta-1,5-dienyl]phenoxathiin-10-ium IUPAC Name: 10-[(1E,5Z)-cycloocta-1,5-dien-1-yl]phenoxathiin-10-ium Traditional Name: 10-[(1E,5Z)-cycloocta-1,5-dien-1-yl]phenoxathiin-10-ium Formula: C20H19OS+ MolecularWeight: 307.42926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(CCC=C1)[S+]2C3=CC=CC=C3OC4=CC=CC=C42

Isomeric SMILES

C/1C/C=C(\CC/C=C1)/[S+]2C3=CC=CC=C3OC4=CC=CC=C42

InChI

InChI=1S/C20H19OS/c1-2-4-10-16(11-5-3-1)22-19-14-8-6-12-17(19)21-18-13-7-9-15-20(18)22/h1-2,6-9,11-15H,3-5,10H2/q+1/b2-1-,16-11+