2-methylsulfanyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carbonitrile

Systemtic Name: 2-methylsulfanyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carbonitrile Openeye Name: 2-methylsulfanyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carbonitrile CAS Name: 2-(methylthio)-6,11-dihydrobenzo[c][1]benzoxepin-11-carbonitrile IUPAC Name: 2-methylsulfanyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carbonitrile Traditional Name: 2-(methylthio)-6,11-dihydrobenzo[c][1]benzoxepin-11-carbonitrile Formula: C16H13NOS MolecularWeight: 267.34552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)OCC3=CC=CC=C3C2C#N

Isomeric SMILES

CSC1=CC2=C(C=C1)OCC3=CC=CC=C3C2C#N

InChI

InChI=1S/C16H13NOS/c1-19-12-6-7-16-14(8-12)15(9-17)13-5-3-2-4-11(13)10-18-16/h2-8,15H,10H2,1H3