2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)pyran-4-one

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)pyran-4-one Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(2-oxo-2-pyrrolidin-1-yl-ethoxy)pyran-4-one CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-[2-oxo-2-(1-pyrrolidinyl)ethoxy]-4-pyranone IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(2-oxo-2-pyrrolidin-1-ylethoxy)pyran-4-one Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(2-keto-2-pyrrolidino-ethoxy)pyran-4-one Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC2=COC(=CC2=O)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCN(C1)C(=O)COC2=COC(=CC2=O)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H24N2O4/c24-19-11-18(13-22-10-7-16-5-1-2-6-17(16)12-22)26-14-20(19)27-15-21(25)23-8-3-4-9-23/h1-2,5-6,11,14H,3-4,7-10,12-13,15H2