5-bromanyl-1-[2-(phenylsulfonyl)ethyl]indole-2,3-dione

Systemtic Name: 5-bromanyl-1-[2-(phenylsulfonyl)ethyl]indole-2,3-dione Openeye Name: 1-[2-(benzenesulfonyl)ethyl]-5-bromo-indoline-2,3-dione CAS Name: 1-[2-(benzenesulfonyl)ethyl]-5-bromoindole-2,3-dione IUPAC Name: 1-[2-(benzenesulfonyl)ethyl]-5-bromoindole-2,3-dione Traditional Name: 1-(2-besylethyl)-5-bromo-isatin Formula: C16H12BrNO4S MolecularWeight: 394.23978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCN2C3=C(C=C(C=C3)Br)C(=O)C2=O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCN2C3=C(C=C(C=C3)Br)C(=O)C2=O

InChI

InChI=1S/C16H12BrNO4S/c17-11-6-7-14-13(10-11)15(19)16(20)18(14)8-9-23(21,22)12-4-2-1-3-5-12/h1-7,10H,8-9H2