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

Systemtic Name: 1-(3-bromanylpropyl)-6-methoxy-3-methyl-2-oxidanylidene-1,3,2-benzodiazaphosphinin-2-ium-4-one Openeye Name: 1-(3-bromopropyl)-6-methoxy-3-methyl-2-oxo-1,3,2-benzodiazaphosphinin-2-ium-4-one CAS Name: 1-(3-bromopropyl)-6-methoxy-3-methyl-2-oxo-1,3,2-benzodiazaphosphorin-2-ium-4-one IUPAC Name: 1-(3-bromopropyl)-6-methoxy-3-methyl-2-oxo-1,3,2-benzodiazaphosphinin-2-ium-4-one Traditional Name: 1-(3-bromopropyl)-2-keto-6-methoxy-3-methyl-1,3,2-benzodiazaphosphorin-2-ium-4-one Formula: C12H15BrN2O3P+ MolecularWeight: 346.136861

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15BrN2O3P/c1-14-12(16)10-8-9(18-2)4-5-11(10)15(19(14)17)7-3-6-13/h4-5,8H,3,6-7H2,1-2H3/q+1