4-[diethoxyphosphoryl(morpholin-4-yl)methyl]-2-methoxy-3-nitro-phenol hydrochloride

Systemtic Name: 4-[diethoxyphosphoryl(morpholin-4-yl)methyl]-2-methoxy-3-nitro-phenol hydrochloride Openeye Name: 4-[diethoxyphosphoryl(morpholino)methyl]-2-methoxy-3-nitro-phenol hydrochloride CAS Name: 4-[diethoxyphosphoryl(4-morpholinyl)methyl]-2-methoxy-3-nitrophenol hydrochloride IUPAC Name: 4-[diethoxyphosphoryl(morpholin-4-yl)methyl]-2-methoxy-3-nitrophenol hydrochloride Traditional Name: 4-[diethoxyphosphoryl(morpholino)methyl]-2-methoxy-3-nitro-phenol hydrochloride Formula: C16H26ClN2O8P MolecularWeight: 440.813001

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=C(C(=C(C=C1)O)OC)[N+](=O)[O-])N2CCOCC2)OCC.Cl

Isomeric SMILES

CCOP(=O)(C(C1=C(C(=C(C=C1)O)OC)[N+](=O)[O-])N2CCOCC2)OCC.Cl

InChI

InChI=1S/C16H25N2O8P.ClH/c1-4-25-27(22,26-5-2)16(17-8-10-24-11-9-17)12-6-7-13(19)15(23-3)14(12)18(20)21;/h6-7,16,19H,4-5,8-11H2,1-3H3;1H