2-phenyl-4-pyrrolidin-1-yl-6,7-dihydro-5H-1,2,3-benzodiazaphosphol-3-ium 3-oxide

Systemtic Name: 2-phenyl-4-pyrrolidin-1-yl-6,7-dihydro-5H-1,2,3-benzodiazaphosphol-3-ium 3-oxide Openeye Name: 2-phenyl-4-pyrrolidin-1-yl-6,7-dihydro-5H-1,2,3-benzodiazaphosphol-3-ium 3-oxide CAS Name: 2-phenyl-4-(1-pyrrolidinyl)-6,7-dihydro-5H-1,2,3-benzodiazaphosphol-3-ium 3-oxide IUPAC Name: 2-phenyl-4-pyrrolidin-1-yl-6,7-dihydro-5H-1,2,3-benzodiazaphosphol-3-ium 3-oxide Traditional Name: 2-phenyl-4-pyrrolidino-6,7-dihydro-5H-1,2,3-benzodiazaphosphol-3-ium 3-oxide Formula: C16H19N3OP+ MolecularWeight: 300.315321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C3C(=NN([P+]3=O)C4=CC=CC=C4)CCC2

Isomeric SMILES

C1CCN(C1)C2=C3C(=NN([P+]3=O)C4=CC=CC=C4)CCC2

InChI

InChI=1S/C16H19N3OP/c20-21-16-14(17-19(21)13-7-2-1-3-8-13)9-6-10-15(16)18-11-4-5-12-18/h1-3,7-8H,4-6,9-12H2/q+1