(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 4-amino-3,5,6-trichloro-pyridine-2-carboxylate CAS Name: 4-amino-3,5,6-trichloro-2-pyridinecarboxylic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 4-amino-3,5,6-trichloropyridine-2-carboxylate Traditional Name: 4-amino-3,5,6-trichloro-picolinic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C18H13Cl3N2O4 MolecularWeight: 427.66582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=NC(=C(C(=C3Cl)N)Cl)Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=NC(=C(C(=C3Cl)N)Cl)Cl)C

InChI

InChI=1S/C18H13Cl3N2O4/c1-7-3-4-10-9(5-11(24)27-16(10)8(7)2)6-26-18(25)15-12(19)14(22)13(20)17(21)23-15/h3-5H,6H2,1-2H3,(H2,22,23)