prop-2-ynyl 4-oxidanylidene-4-[[2,4,6-tris(chloranyl)phenyl]amino]butanoate

Systemtic Name: prop-2-ynyl 4-oxidanylidene-4-[[2,4,6-tris(chloranyl)phenyl]amino]butanoate Openeye Name: prop-2-ynyl 4-oxo-4-(2,4,6-trichloroanilino)butanoate CAS Name: 4-oxo-4-(2,4,6-trichloroanilino)butanoic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-oxo-4-(2,4,6-trichloroanilino)butanoate Traditional Name: 4-keto-4-(2,4,6-trichloroanilino)butyric acid propargyl ester Formula: C13H10Cl3NO3 MolecularWeight: 334.5824

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)CCC(=O)NC1=C(C=C(C=C1Cl)Cl)Cl

Isomeric SMILES

C#CCOC(=O)CCC(=O)NC1=C(C=C(C=C1Cl)Cl)Cl

InChI

InChI=1S/C13H10Cl3NO3/c1-2-5-20-12(19)4-3-11(18)17-13-9(15)6-8(14)7-10(13)16/h1,6-7H,3-5H2,(H,17,18)