[(2S)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl] 5,6-bis(chloranyl)pyridine-3-carboxylate

Systemtic Name: [(2S)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl] 5,6-bis(chloranyl)pyridine-3-carboxylate Openeye Name: [(1S)-2-(4-ethoxyphenyl)-1-methyl-2-oxo-ethyl] 5,6-dichloropyridine-3-carboxylate CAS Name: 5,6-dichloro-3-pyridinecarboxylic acid [(2S)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl] 5,6-dichloropyridine-3-carboxylate Traditional Name: 5,6-dichloronicotinic acid [(1S)-2-keto-1-methyl-2-p-phenetyl-ethyl] ester Formula: C17H15Cl2NO4 MolecularWeight: 368.2113

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC(=C(N=C2)Cl)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)C2=CC(=C(N=C2)Cl)Cl

InChI

InChI=1S/C17H15Cl2NO4/c1-3-23-13-6-4-11(5-7-13)15(21)10(2)24-17(22)12-8-14(18)16(19)20-9-12/h4-10H,3H2,1-2H3/t10-/m0/s1