cyclopentyl-[1-(4-fluorophenyl)-7-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]methanone

Systemtic Name: cyclopentyl-[1-(4-fluorophenyl)-7-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]methanone Openeye Name: cyclopentyl-[1-(4-fluorophenyl)-7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone CAS Name: cyclopentyl-[1-(4-fluorophenyl)-7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone IUPAC Name: cyclopentyl-[1-(4-fluorophenyl)-7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone Traditional Name: cyclopentyl-[1-(4-fluorophenyl)-7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone Formula: C21H22FNO2 MolecularWeight: 339.403283

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)N2CCC3=C(C2C4=CC=C(C=C4)F)C=C(C=C3)O

Isomeric SMILES

C1CCC(C1)C(=O)N2CCC3=C(C2C4=CC=C(C=C4)F)C=C(C=C3)O

InChI

InChI=1S/C21H22FNO2/c22-17-8-5-15(6-9-17)20-19-13-18(24)10-7-14(19)11-12-23(20)21(25)16-3-1-2-4-16/h5-10,13,16,20,24H,1-4,11-12H2