2-(furan-2-ylcarbonyl)-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(furan-2-ylcarbonyl)-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(furan-2-carbonyl)-N-[[2-(1-piperidylmethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-furanyl(oxo)methyl]-N-[[2-(1-piperidinylmethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(furan-2-carbonyl)-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(2-furoyl)-N-[2-(piperidinomethyl)benzyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3CC4=CC=CC=C4CN3C(=O)C5=CC=CO5

Isomeric SMILES

C1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3CC4=CC=CC=C4CN3C(=O)C5=CC=CO5

InChI

InChI=1S/C28H31N3O3/c32-27(29-18-22-10-3-5-11-23(22)19-30-14-6-1-7-15-30)25-17-21-9-2-4-12-24(21)20-31(25)28(33)26-13-8-16-34-26/h2-5,8-13,16,25H,1,6-7,14-15,17-20H2,(H,29,32)