4-[5-[(3-oxidanylpyrrolidin-1-yl)methyl]furan-2-yl]-5,6,7,8-tetrahydro-2H-isoquinolin-1-one

Systemtic Name: 4-[5-[(3-oxidanylpyrrolidin-1-yl)methyl]furan-2-yl]-5,6,7,8-tetrahydro-2H-isoquinolin-1-one Openeye Name: 4-[5-[(3-hydroxypyrrolidin-1-yl)methyl]-2-furyl]-5,6,7,8-tetrahydro-2H-isoquinolin-1-one CAS Name: 4-[5-[(3-hydroxy-1-pyrrolidinyl)methyl]-2-furanyl]-5,6,7,8-tetrahydro-2H-isoquinolin-1-one IUPAC Name: 4-[5-[(3-hydroxypyrrolidin-1-yl)methyl]furan-2-yl]-5,6,7,8-tetrahydro-2H-isoquinolin-1-one Traditional Name: 4-[5-[(3-hydroxypyrrolidino)methyl]-2-furyl]-5,6,7,8-tetrahydro-2H-isoquinolin-1-one Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CNC2=O)C3=CC=C(O3)CN4CCC(C4)O

Isomeric SMILES

C1CCC2=C(C1)C(=CNC2=O)C3=CC=C(O3)CN4CCC(C4)O

InChI

InChI=1S/C18H22N2O3/c21-12-7-8-20(10-12)11-13-5-6-17(23-13)16-9-19-18(22)15-4-2-1-3-14(15)16/h5-6,9,12,21H,1-4,7-8,10-11H2,(H,19,22)