1-[5,5-bis(oxidanylidene)benzo[b]phenothiazin-12-yl]-2-chloranyl-ethanone

Systemtic Name: 1-[5,5-bis(oxidanylidene)benzo[b]phenothiazin-12-yl]-2-chloranyl-ethanone Openeye Name: 2-chloro-1-(5,5-dioxobenzo[b]phenothiazin-12-yl)ethanone CAS Name: 2-chloro-1-(5,5-dioxo-12-benzo[b]phenothiazinyl)ethanone IUPAC Name: 2-chloro-1-(5,5-dioxobenzo[b]phenothiazin-12-yl)ethanone Traditional Name: 2-chloro-1-(5,5-diketobenzo[b]phenothiazin-12-yl)ethanone Formula: C18H12ClNO3S MolecularWeight: 357.81078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C(=CC2=C1)N(C4=CC=CC=C4S3(=O)=O)C(=O)CCl

Isomeric SMILES

C1=CC=C2C=C3C(=CC2=C1)N(C4=CC=CC=C4S3(=O)=O)C(=O)CCl

InChI

InChI=1S/C18H12ClNO3S/c19-11-18(21)20-14-7-3-4-8-16(14)24(22,23)17-10-13-6-2-1-5-12(13)9-15(17)20/h1-10H,11H2