(3-methoxycarbonylphenyl)methyl 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: (3-methoxycarbonylphenyl)methyl 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate Openeye Name: (3-methoxycarbonylphenyl)methyl 2-chloro-4,6-dimethyl-pyridine-3-carboxylate CAS Name: 2-chloro-4,6-dimethyl-3-pyridinecarboxylic acid (3-methoxycarbonylphenyl)methyl ester IUPAC Name: (3-methoxycarbonylphenyl)methyl 2-chloro-4,6-dimethylpyridine-3-carboxylate Traditional Name: 2-chloro-4,6-dimethyl-nicotinic acid (3-carbomethoxybenzyl) ester Formula: C17H16ClNO4 MolecularWeight: 333.76624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)OCC2=CC=CC(=C2)C(=O)OC)Cl)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)OCC2=CC=CC(=C2)C(=O)OC)Cl)C

InChI

InChI=1S/C17H16ClNO4/c1-10-7-11(2)19-15(18)14(10)17(21)23-9-12-5-4-6-13(8-12)16(20)22-3/h4-8H,9H2,1-3H3