(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl 2-chloranylpyridine-3-carboxylate

Systemtic Name: (5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl 2-chloranylpyridine-3-carboxylate Openeye Name: (5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl 2-chloropyridine-3-carboxylate CAS Name: 2-chloro-3-pyridinecarboxylic acid (5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl ester IUPAC Name: (5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl 2-chloropyridine-3-carboxylate Traditional Name: 2-chloronicotinic acid (5-ethoxy-2-methyl-coumaran-6-yl)methyl ester Formula: C18H18ClNO4 MolecularWeight: 347.79282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)COC(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)COC(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C18H18ClNO4/c1-3-22-15-8-12-7-11(2)24-16(12)9-13(15)10-23-18(21)14-5-4-6-20-17(14)19/h4-6,8-9,11H,3,7,10H2,1-2H3