1-methyl-1-(phenylmethyl)phospholan-1-ium-3-one bromide

Systemtic Name: 1-methyl-1-(phenylmethyl)phospholan-1-ium-3-one bromide Openeye Name: 1-benzyl-1-methyl-phospholan-1-ium-3-one bromide CAS Name: 1-methyl-1-(phenylmethyl)-3-phospholan-1-iumone bromide IUPAC Name: 1-benzyl-1-methylphospholan-1-ium-3-one bromide Traditional Name: 1-benzyl-1-methyl-phospholan-1-ium-3-one bromide Formula: C12H16BrOP MolecularWeight: 287.132601

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Descriptors Computed from Structure

Canonical SMILES:

C[P+]1(CCC(=O)C1)CC2=CC=CC=C2.[Br-]

Isomeric SMILES

C[P+]1(CCC(=O)C1)CC2=CC=CC=C2.[Br-]

InChI

InChI=1S/C12H16OP.BrH/c1-14(8-7-12(13)10-14)9-11-5-3-2-4-6-11;/h2-6H,7-10H2,1H3;1H/q+1;/p-1