1-[7,7-bis(oxidanylidene)benzo[a]phenothiazin-12-yl]-2-bromanyl-ethanone

Systemtic Name: 1-[7,7-bis(oxidanylidene)benzo[a]phenothiazin-12-yl]-2-bromanyl-ethanone Openeye Name: 2-bromo-1-(7,7-dioxobenzo[a]phenothiazin-12-yl)ethanone CAS Name: 2-bromo-1-(7,7-dioxo-12-benzo[a]phenothiazinyl)ethanone IUPAC Name: 2-bromo-1-(7,7-dioxobenzo[a]phenothiazin-12-yl)ethanone Traditional Name: 2-bromo-1-(7,7-diketobenzo[a]phenothiazin-12-yl)ethanone Formula: C18H12BrNO3S MolecularWeight: 402.26178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2N(C4=CC=CC=C4S3(=O)=O)C(=O)CBr

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2N(C4=CC=CC=C4S3(=O)=O)C(=O)CBr

InChI

InChI=1S/C18H12BrNO3S/c19-11-17(21)20-14-7-3-4-8-15(14)24(22,23)16-10-9-12-5-1-2-6-13(12)18(16)20/h1-10H,11H2