3-[5-[1-(dimethoxyphosphorylmethylamino)-2-(9H-fluoren-2-yl)ethyl]-1,2,3,4-tetrazol-1-yl]propanenitrile

Systemtic Name: 3-[5-[1-(dimethoxyphosphorylmethylamino)-2-(9H-fluoren-2-yl)ethyl]-1,2,3,4-tetrazol-1-yl]propanenitrile Openeye Name: 3-[5-[1-(dimethoxyphosphorylmethylamino)-2-(9H-fluoren-2-yl)ethyl]tetrazol-1-yl]propanenitrile CAS Name: 3-[5-[1-(dimethoxyphosphorylmethylamino)-2-(9H-fluoren-2-yl)ethyl]-1-tetrazolyl]propanenitrile IUPAC Name: 3-[5-[1-(dimethoxyphosphorylmethylamino)-2-(9H-fluoren-2-yl)ethyl]tetrazol-1-yl]propanenitrile Traditional Name: 3-[5-[1-(dimethoxyphosphorylmethylamino)-2-(9H-fluoren-2-yl)ethyl]tetrazol-1-yl]propionitrile Formula: C22H25N6O3P MolecularWeight: 452.446061

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(CNC(CC1=CC2=C(C=C1)C3=CC=CC=C3C2)C4=NN=NN4CCC#N)OC

Isomeric SMILES

COP(=O)(CNC(CC1=CC2=C(C=C1)C3=CC=CC=C3C2)C4=NN=NN4CCC#N)OC

InChI

InChI=1S/C22H25N6O3P/c1-30-32(29,31-2)15-24-21(22-25-26-27-28(22)11-5-10-23)13-16-8-9-20-18(12-16)14-17-6-3-4-7-19(17)20/h3-4,6-9,12,21,24H,5,11,13-15H2,1-2H3