ethyl 4-[[2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinolin-3-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinolin-3-yl]carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-[2-furanyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-(2-furoyl)-3,4-dihydro-1H-isoquinoline-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC=CO4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC=CO4

InChI

InChI=1S/C22H25N3O5/c1-2-29-22(28)24-11-9-23(10-12-24)20(26)18-14-16-6-3-4-7-17(16)15-25(18)21(27)19-8-5-13-30-19/h3-8,13,18H,2,9-12,14-15H2,1H3