[(S)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-[2,2-bis(chloranyl)ethenyl]-2,2-dimethyl-cyclopropane-1-carboxylate; dimethyl [(E)-4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] phosphate

Systemtic Name: [(S)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-[2,2-bis(chloranyl)ethenyl]-2,2-dimethyl-cyclopropane-1-carboxylate; dimethyl [(E)-4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] phosphate Openeye Name: [(S)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-(2,2-dichlorovinyl)-2,2-dimethyl-cyclopropanecarboxylate; dimethyl [(E)-1-methyl-3-(methylamino)-3-oxo-prop-1-enyl] phosphate CAS Name: (1S,3S)-3-(2,2-dichloroethenyl)-2,2-dimethyl-1-cyclopropanecarboxylic acid [(S)-cyano-(3-phenoxyphenyl)methyl] ester; phosphoric acid dimethyl [(E)-4-(methylamino)-4-oxobut-2-en-2-yl] ester IUPAC Name: [(S)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate; dimethyl [(E)-4-(methylamino)-4-oxobut-2-en-2-yl] phosphate Traditional Name: (1S,3S)-3-(2,2-dichlorovinyl)-2,2-dimethyl-cyclopropanecarboxylic acid [(S)-cyano-(3-phenoxyphenyl)methyl] ester; phosphoric acid [(E)-3-keto-1-methyl-3-(methylamino)prop-1-enyl] dimethyl ester Formula: C29H33Cl2N2O8P MolecularWeight: 639.460681

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC)OP(=O)(OC)OC.CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C

Isomeric SMILES

C/C(=C\C(=O)NC)/OP(=O)(OC)OC.CC1([C@@H]([C@@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C

InChI

InChI=1S/C22H19Cl2NO3.C7H14NO5P/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15;1-6(5-7(9)8-2)13-14(10,11-3)12-4/h3-12,17-18,20H,1-2H3;5H,1-4H3,(H,8,9)/b;6-5+/t17-,18-,20-;/m1./s1