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

Systemtic Name: 3-(3-chloranylpropyl)-6-methoxy-1-methyl-2-oxidanylidene-1,3,2-benzodiazaphosphinin-2-ium-4-one Openeye Name: 3-(3-chloropropyl)-6-methoxy-1-methyl-2-oxo-1,3,2-benzodiazaphosphinin-2-ium-4-one CAS Name: 3-(3-chloropropyl)-6-methoxy-1-methyl-2-oxo-1,3,2-benzodiazaphosphorin-2-ium-4-one IUPAC Name: 3-(3-chloropropyl)-6-methoxy-1-methyl-2-oxo-1,3,2-benzodiazaphosphinin-2-ium-4-one Traditional Name: 3-(3-chloropropyl)-2-keto-6-methoxy-1-methyl-1,3,2-benzodiazaphosphorin-2-ium-4-one Formula: C12H15ClN2O3P+ MolecularWeight: 301.685861

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)C(=O)N([P+]1=O)CCCCl

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)C(=O)N([P+]1=O)CCCCl

InChI

InChI=1S/C12H15ClN2O3P/c1-14-11-5-4-9(18-2)8-10(11)12(16)15(19(14)17)7-3-6-13/h4-5,8H,3,6-7H2,1-2H3/q+1