4-[2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-1-oxidanylidene-3,4-dihydroisoquinolin-6-yl]-N-ethyl-3-fluoranyl-benzamide

Systemtic Name: 4-[2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-1-oxidanylidene-3,4-dihydroisoquinolin-6-yl]-N-ethyl-3-fluoranyl-benzamide Openeye Name: 4-[2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-1-oxo-3,4-dihydroisoquinolin-6-yl]-N-ethyl-3-fluoro-benzamide CAS Name: 4-[2-[(3S)-1-cyclobutyl-3-pyrrolidinyl]-1-oxo-3,4-dihydroisoquinolin-6-yl]-N-ethyl-3-fluorobenzamide IUPAC Name: 4-[2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-1-oxo-3,4-dihydroisoquinolin-6-yl]-N-ethyl-3-fluorobenzamide Traditional Name: 4-[2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-1-keto-3,4-dihydroisoquinolin-6-yl]-N-ethyl-3-fluoro-benzamide Formula: C26H30FN3O2 MolecularWeight: 435.533703

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=C(C=C1)C2=CC3=C(C=C2)C(=O)N(CC3)C4CCN(C4)C5CCC5)F

Isomeric SMILES

CCNC(=O)C1=CC(=C(C=C1)C2=CC3=C(C=C2)C(=O)N(CC3)[C@H]4CCN(C4)C5CCC5)F

InChI

InChI=1S/C26H30FN3O2/c1-2-28-25(31)19-7-8-22(24(27)15-19)17-6-9-23-18(14-17)10-13-30(26(23)32)21-11-12-29(16-21)20-4-3-5-20/h6-9,14-15,20-21H,2-5,10-13,16H2,1H3,(H,28,31)/t21-/m0/s1