dihydrogen phosphate; 4-(3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1,1-diphenyl-but-2-yn-1-ol

Systemtic Name: dihydrogen phosphate; 4-(3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1,1-diphenyl-but-2-yn-1-ol Openeye Name: dihydrogen phosphate; 4-(3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1,1-diphenyl-but-2-yn-1-ol CAS Name: dihydrogen phosphate; 4-(3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1,1-diphenyl-2-butyn-1-ol IUPAC Name: dihydrogen phosphate; 4-(3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1,1-diphenylbut-2-yn-1-ol Traditional Name: dihydrogen phosphate; 1,1-diphenyl-4-(1-pyrrolin-1-ium-1-yl)but-2-yn-1-ol Formula: C20H22NO5P MolecularWeight: 387.366141

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=[N+](C1)CC#CC(C2=CC=CC=C2)(C3=CC=CC=C3)O.OP(=O)(O)[O-]

Isomeric SMILES

C1CC=[N+](C1)CC#CC(C2=CC=CC=C2)(C3=CC=CC=C3)O.OP(=O)(O)[O-]

InChI

InChI=1S/C20H20NO.H3O4P/c22-20(18-10-3-1-4-11-18,19-12-5-2-6-13-19)14-9-17-21-15-7-8-16-21;1-5(2,3)4/h1-6,10-13,15,22H,7-8,16-17H2;(H3,1,2,3,4)/q+1;/p-1