ethyl 5-[3-(4-chlorophenyl)carbonyloxyprop-1-ynyl]pyridine-3-carboxylate

Systemtic Name: ethyl 5-[3-(4-chlorophenyl)carbonyloxyprop-1-ynyl]pyridine-3-carboxylate Openeye Name: ethyl 5-[3-(4-chlorobenzoyl)oxyprop-1-ynyl]pyridine-3-carboxylate CAS Name: 5-[3-[(4-chlorophenyl)-oxomethoxy]prop-1-ynyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(4-chlorobenzoyl)oxyprop-1-ynyl]pyridine-3-carboxylate Traditional Name: 5-[3-(4-chlorobenzoyl)oxyprop-1-ynyl]nicotinic acid ethyl ester Formula: C18H14ClNO4 MolecularWeight: 343.76106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=CC(=C1)C#CCOC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CN=CC(=C1)C#CCOC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H14ClNO4/c1-2-23-18(22)15-10-13(11-20-12-15)4-3-9-24-17(21)14-5-7-16(19)8-6-14/h5-8,10-12H,2,9H2,1H3