2-[1,4-bis(chloranyl)-3-oxidanyl-butan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[1,4-bis(chloranyl)-3-oxidanyl-butan-2-yl]isoindole-1,3-dione Openeye Name: 2-[3-chloro-1-(chloromethyl)-2-hydroxy-propyl]isoindoline-1,3-dione CAS Name: 2-(1,4-dichloro-3-hydroxybutan-2-yl)isoindole-1,3-dione IUPAC Name: 2-(1,4-dichloro-3-hydroxybutan-2-yl)isoindole-1,3-dione Traditional Name: 2-[3-chloro-1-(chloromethyl)-2-hydroxy-propyl]isoindoline-1,3-quinone Formula: C12H11Cl2NO3 MolecularWeight: 288.12664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C(CCl)C(CCl)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C(CCl)C(CCl)O

InChI

InChI=1S/C12H11Cl2NO3/c13-5-9(10(16)6-14)15-11(17)7-3-1-2-4-8(7)12(15)18/h1-4,9-10,16H,5-6H2