[1-diethoxyphosphoryl-2-(3-imidazol-1-ylpropylamino)ethyl] diethyl phosphate

Systemtic Name: [1-diethoxyphosphoryl-2-(3-imidazol-1-ylpropylamino)ethyl] diethyl phosphate Openeye Name: [1-diethoxyphosphoryl-2-(3-imidazol-1-ylpropylamino)ethyl] diethyl phosphate CAS Name: phosphoric acid [1-diethoxyphosphoryl-2-[3-(1-imidazolyl)propylamino]ethyl] diethyl ester IUPAC Name: [1-diethoxyphosphoryl-2-(3-imidazol-1-ylpropylamino)ethyl] diethyl phosphate Traditional Name: phosphoric acid [1-diethoxyphosphoryl-2-(3-imidazol-1-ylpropylamino)ethyl] diethyl ester Formula: C16H33N3O7P2 MolecularWeight: 441.396642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CNCCCN1C=CN=C1)OP(=O)(OCC)OCC)OCC

Isomeric SMILES

CCOP(=O)(C(CNCCCN1C=CN=C1)OP(=O)(OCC)OCC)OCC

InChI

InChI=1S/C16H33N3O7P2/c1-5-22-27(20,23-6-2)16(26-28(21,24-7-3)25-8-4)14-17-10-9-12-19-13-11-18-15-19/h11,13,15-17H,5-10,12,14H2,1-4H3