1,3-bis(diethoxyphosphorylmethyl)-3,4-dihydro-2H-quinazolin-3-ium

Systemtic Name: 1,3-bis(diethoxyphosphorylmethyl)-3,4-dihydro-2H-quinazolin-3-ium Openeye Name: 1,3-bis(diethoxyphosphorylmethyl)-3,4-dihydro-2H-quinazolin-3-ium CAS Name: 1,3-bis(diethoxyphosphorylmethyl)-3,4-dihydro-2H-quinazolin-3-ium IUPAC Name: 1,3-bis(diethoxyphosphorylmethyl)-3,4-dihydro-2H-quinazolin-3-ium Traditional Name: 1,3-bis(diethoxyphosphorylmethyl)-3,4-dihydro-2H-quinazolin-3-ium Formula: C18H33N2O6P2+ MolecularWeight: 435.411942

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C[NH+]1CC2=CC=CC=C2N(C1)CP(=O)(OCC)OCC)OCC

Isomeric SMILES

CCOP(=O)(C[NH+]1CC2=CC=CC=C2N(C1)CP(=O)(OCC)OCC)OCC

InChI

InChI=1S/C18H32N2O6P2/c1-5-23-27(21,24-6-2)15-19-13-17-11-9-10-12-18(17)20(14-19)16-28(22,25-7-3)26-8-4/h9-12H,5-8,13-16H2,1-4H3/p+1