2-[9-bromanyl-5,5-bis(oxidanylidene)benzo[c][1,2]benzothiazin-6-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[9-bromanyl-5,5-bis(oxidanylidene)benzo[c][1,2]benzothiazin-6-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(9-bromo-5,5-dioxo-benzo[c][1,2]benzothiazin-6-yl)-1-pyrrolidin-1-yl-ethanone CAS Name: 2-(9-bromo-5,5-dioxo-6-benzo[c][1,2]benzothiazinyl)-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(9-bromo-5,5-dioxobenzo[c][1,2]benzothiazin-6-yl)-1-pyrrolidin-1-ylethanone Traditional Name: 2-(9-bromo-5,5-diketo-benzo[c][1,2]benzothiazin-6-yl)-1-pyrrolidino-ethanone Formula: C18H17BrN2O3S MolecularWeight: 421.30818

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2C3=C(C=C(C=C3)Br)C4=CC=CC=C4S2(=O)=O

Isomeric SMILES

C1CCN(C1)C(=O)CN2C3=C(C=C(C=C3)Br)C4=CC=CC=C4S2(=O)=O

InChI

InChI=1S/C18H17BrN2O3S/c19-13-7-8-16-15(11-13)14-5-1-2-6-17(14)25(23,24)21(16)12-18(22)20-9-3-4-10-20/h1-2,5-8,11H,3-4,9-10,12H2