[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl] 5,6-bis(chloranyl)pyridine-3-carboxylate

Systemtic Name: [2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl] 5,6-bis(chloranyl)pyridine-3-carboxylate Openeye Name: [2-(4-tert-butylphenyl)-2-oxo-ethyl] 5,6-dichloropyridine-3-carboxylate CAS Name: 5,6-dichloro-3-pyridinecarboxylic acid [2-(4-tert-butylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-tert-butylphenyl)-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate Traditional Name: 5,6-dichloronicotinic acid [2-(4-tert-butylphenyl)-2-keto-ethyl] ester Formula: C18H17Cl2NO3 MolecularWeight: 366.23848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=C(N=C2)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=C(N=C2)Cl)Cl

InChI

InChI=1S/C18H17Cl2NO3/c1-18(2,3)13-6-4-11(5-7-13)15(22)10-24-17(23)12-8-14(19)16(20)21-9-12/h4-9H,10H2,1-3H3