ethyl 6-[4-(2,3-dihydro-1-benzofuran-2-ylcarbonyl)piperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[4-(2,3-dihydro-1-benzofuran-2-ylcarbonyl)piperazin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[4-(2,3-dihydrobenzofuran-2-carbonyl)piperazin-1-yl]pyridine-3-carboxylate CAS Name: 6-[4-[2,3-dihydrobenzofuran-2-yl(oxo)methyl]-1-piperazinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-(2,3-dihydro-1-benzofuran-2-carbonyl)piperazin-1-yl]pyridine-3-carboxylate Traditional Name: 6-[4-(coumaran-2-carbonyl)piperazino]nicotinic acid ethyl ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)C(=O)C3CC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)C(=O)C3CC4=CC=CC=C4O3

InChI

InChI=1S/C21H23N3O4/c1-2-27-21(26)16-7-8-19(22-14-16)23-9-11-24(12-10-23)20(25)18-13-15-5-3-4-6-17(15)28-18/h3-8,14,18H,2,9-13H2,1H3