6-diethoxyphosphoryl-4-methyl-1-(4-nitrophenyl)-3-prop-2-enyl-4H-pyrimidin-2-one

Systemtic Name: 6-diethoxyphosphoryl-4-methyl-1-(4-nitrophenyl)-3-prop-2-enyl-4H-pyrimidin-2-one Openeye Name: 3-allyl-6-diethoxyphosphoryl-4-methyl-1-(4-nitrophenyl)-4H-pyrimidin-2-one CAS Name: 6-diethoxyphosphoryl-4-methyl-1-(4-nitrophenyl)-3-prop-2-enyl-4H-pyrimidin-2-one IUPAC Name: 6-diethoxyphosphoryl-4-methyl-1-(4-nitrophenyl)-3-prop-2-enyl-4H-pyrimidin-2-one Traditional Name: 3-allyl-6-diethoxyphosphoryl-4-methyl-1-(4-nitrophenyl)-4H-pyrimidin-2-one Formula: C18H24N3O6P MolecularWeight: 409.373421

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=CC(N(C(=O)N1C2=CC=C(C=C2)[N+](=O)[O-])CC=C)C)OCC

Isomeric SMILES

CCOP(=O)(C1=CC(N(C(=O)N1C2=CC=C(C=C2)[N+](=O)[O-])CC=C)C)OCC

InChI

InChI=1S/C18H24N3O6P/c1-5-12-19-14(4)13-17(28(25,26-6-2)27-7-3)20(18(19)22)15-8-10-16(11-9-15)21(23)24/h5,8-11,13-14H,1,6-7,12H2,2-4H3