2-(4-bromophenyl)-9,9a-dihydro-3aH-pyrrolo[3,4-b][1,4]benzothiazine-1,3-dione

Systemtic Name: 2-(4-bromophenyl)-9,9a-dihydro-3aH-pyrrolo[3,4-b][1,4]benzothiazine-1,3-dione Openeye Name: 2-(4-bromophenyl)-9,9a-dihydro-3aH-pyrrolo[3,4-b][1,4]benzothiazine-1,3-dione CAS Name: 2-(4-bromophenyl)-9,9a-dihydro-3aH-pyrrolo[3,4-b][1,4]benzothiazine-1,3-dione IUPAC Name: 2-(4-bromophenyl)-9,9a-dihydro-3aH-pyrrolo[3,4-b][1,4]benzothiazine-1,3-dione Traditional Name: 2-(4-bromophenyl)-9,9a-dihydro-3aH-pyrrolo[3,4-b][1,4]benzothiazine-1,3-quinone Formula: C16H11BrN2O2S MolecularWeight: 375.23974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC3C(S2)C(=O)N(C3=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)NC3C(S2)C(=O)N(C3=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C16H11BrN2O2S/c17-9-5-7-10(8-6-9)19-15(20)13-14(16(19)21)22-12-4-2-1-3-11(12)18-13/h1-8,13-14,18H