5,6-bis(chloranyl)-2-(2-diethoxyphosphoryl-1-pyridin-3-yl-prop-2-enyl)isoindole-1,3-dione

Systemtic Name: 5,6-bis(chloranyl)-2-(2-diethoxyphosphoryl-1-pyridin-3-yl-prop-2-enyl)isoindole-1,3-dione Openeye Name: 5,6-dichloro-2-[2-diethoxyphosphoryl-1-(3-pyridyl)allyl]isoindoline-1,3-dione CAS Name: 5,6-dichloro-2-[2-diethoxyphosphoryl-1-(3-pyridinyl)prop-2-enyl]isoindole-1,3-dione IUPAC Name: 5,6-dichloro-2-(2-diethoxyphosphoryl-1-pyridin-3-ylprop-2-enyl)isoindole-1,3-dione Traditional Name: 5,6-dichloro-2-[2-diethoxyphosphoryl-1-(3-pyridyl)allyl]isoindoline-1,3-quinone Formula: C20H19Cl2N2O5P MolecularWeight: 469.255021

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(=C)C(C1=CN=CC=C1)N2C(=O)C3=CC(=C(C=C3C2=O)Cl)Cl)OCC

Isomeric SMILES

CCOP(=O)(C(=C)C(C1=CN=CC=C1)N2C(=O)C3=CC(=C(C=C3C2=O)Cl)Cl)OCC

InChI

InChI=1S/C20H19Cl2N2O5P/c1-4-28-30(27,29-5-2)12(3)18(13-7-6-8-23-11-13)24-19(25)14-9-16(21)17(22)10-15(14)20(24)26/h6-11,18H,3-5H2,1-2H3