1-(3-bromanylpropyl)-6-chloranyl-3-methyl-2-oxidanylidene-1,3,2-benzodiazaphosphinin-2-ium-4-one

Systemtic Name: 1-(3-bromanylpropyl)-6-chloranyl-3-methyl-2-oxidanylidene-1,3,2-benzodiazaphosphinin-2-ium-4-one Openeye Name: 1-(3-bromopropyl)-6-chloro-3-methyl-2-oxo-1,3,2-benzodiazaphosphinin-2-ium-4-one CAS Name: 1-(3-bromopropyl)-6-chloro-3-methyl-2-oxo-1,3,2-benzodiazaphosphorin-2-ium-4-one IUPAC Name: 1-(3-bromopropyl)-6-chloro-3-methyl-2-oxo-1,3,2-benzodiazaphosphinin-2-ium-4-one Traditional Name: 1-(3-bromopropyl)-6-chloro-2-keto-3-methyl-1,3,2-benzodiazaphosphorin-2-ium-4-one Formula: C11H12BrClN2O2P+ MolecularWeight: 350.555941

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=CC(=C2)Cl)N([P+]1=O)CCCBr

Isomeric SMILES

CN1C(=O)C2=C(C=CC(=C2)Cl)N([P+]1=O)CCCBr

InChI

InChI=1S/C11H12BrClN2O2P/c1-14-11(16)9-7-8(13)3-4-10(9)15(18(14)17)6-2-5-12/h3-4,7H,2,5-6H2,1H3/q+1