2-[2-(4-chloranylphenoxy)-2-methyl-propanoyl]oxyethyl pyridine-3-carboxylate hydrochloride

Systemtic Name: 2-[2-(4-chloranylphenoxy)-2-methyl-propanoyl]oxyethyl pyridine-3-carboxylate hydrochloride Openeye Name: 2-[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxyethyl pyridine-3-carboxylate hydrochloride CAS Name: 3-pyridinecarboxylic acid 2-[2-(4-chlorophenoxy)-2-methyl-1-oxopropoxy]ethyl ester hydrochloride IUPAC Name: 2-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxyethyl pyridine-3-carboxylate hydrochloride Traditional Name: nicotinic acid 2-[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxyethyl ester hydrochloride Formula: C18H19Cl2NO5 MolecularWeight: 400.25316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OCCOC(=O)C1=CN=CC=C1)OC2=CC=C(C=C2)Cl.Cl

Isomeric SMILES

CC(C)(C(=O)OCCOC(=O)C1=CN=CC=C1)OC2=CC=C(C=C2)Cl.Cl

InChI

InChI=1S/C18H18ClNO5.ClH/c1-18(2,25-15-7-5-14(19)6-8-15)17(22)24-11-10-23-16(21)13-4-3-9-20-12-13;/h3-9,12H,10-11H2,1-2H3;1H