diphosphanyl 2-acetamido-3-[3-methyl-4-(1,4,5,6-tetramethyl-2-oxidanylidene-pyridin-3-yl)phenyl]propanoate

Systemtic Name: diphosphanyl 2-acetamido-3-[3-methyl-4-(1,4,5,6-tetramethyl-2-oxidanylidene-pyridin-3-yl)phenyl]propanoate Openeye Name: diphosphanyl 2-acetamido-3-[3-methyl-4-(1,4,5,6-tetramethyl-2-oxo-3-pyridyl)phenyl]propanoate CAS Name: 2-acetamido-3-[3-methyl-4-(1,4,5,6-tetramethyl-2-oxo-3-pyridinyl)phenyl]propanoic acid diphosphanyl ester IUPAC Name: diphosphanyl 2-acetamido-3-[3-methyl-4-(1,4,5,6-tetramethyl-2-oxopyridin-3-yl)phenyl]propanoate Traditional Name: 2-acetamido-3-[4-(2-keto-1,4,5,6-tetramethyl-3-pyridyl)-3-methyl-phenyl]propionic acid diphosphanyl ester Formula: C21H28N2O4P2 MolecularWeight: 434.405542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CC(C(=O)OPP)NC(=O)C)C2=C(C(=C(N(C2=O)C)C)C)C

Isomeric SMILES

CC1=C(C=CC(=C1)CC(C(=O)OPP)NC(=O)C)C2=C(C(=C(N(C2=O)C)C)C)C

InChI

InChI=1S/C21H28N2O4P2/c1-11-9-16(10-18(22-15(5)24)21(26)27-29-28)7-8-17(11)19-13(3)12(2)14(4)23(6)20(19)25/h7-9,18,29H,10,28H2,1-6H3,(H,22,24)