ethyl (E)-3-(1-oxidanylpropan-2-ylamino)-2-[4,5,6-tris(chloranyl)pyridin-3-yl]carbonyl-prop-2-enoate

Systemtic Name: ethyl (E)-3-(1-oxidanylpropan-2-ylamino)-2-[4,5,6-tris(chloranyl)pyridin-3-yl]carbonyl-prop-2-enoate Openeye Name: ethyl (E)-3-[(2-hydroxy-1-methyl-ethyl)amino]-2-(4,5,6-trichloropyridine-3-carbonyl)prop-2-enoate CAS Name: (E)-3-(1-hydroxypropan-2-ylamino)-2-[oxo-(4,5,6-trichloro-3-pyridinyl)methyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(1-hydroxypropan-2-ylamino)-2-(4,5,6-trichloropyridine-3-carbonyl)prop-2-enoate Traditional Name: (E)-3-[(2-hydroxy-1-methyl-ethyl)amino]-2-(4,5,6-trichloronicotinoyl)acrylic acid ethyl ester Formula: C14H15Cl3N2O4 MolecularWeight: 381.6389

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC(C)CO)C(=O)C1=CN=C(C(=C1Cl)Cl)Cl

Isomeric SMILES

CCOC(=O)/C(=C/NC(C)CO)/C(=O)C1=CN=C(C(=C1Cl)Cl)Cl

InChI

InChI=1S/C14H15Cl3N2O4/c1-3-23-14(22)9(5-18-7(2)6-20)12(21)8-4-19-13(17)11(16)10(8)15/h4-5,7,18,20H,3,6H2,1-2H3/b9-5+