2-[2-[4-[(5-fluoranyl-1H-indol-3-yl)methyl]piperidin-1-yl]ethyl]-4,4-dimethyl-3H-isoquinolin-1-one

Systemtic Name: 2-[2-[4-[(5-fluoranyl-1H-indol-3-yl)methyl]piperidin-1-yl]ethyl]-4,4-dimethyl-3H-isoquinolin-1-one Openeye Name: 2-[2-[4-[(5-fluoro-1H-indol-3-yl)methyl]-1-piperidyl]ethyl]-4,4-dimethyl-3H-isoquinolin-1-one CAS Name: 2-[2-[4-[(5-fluoro-1H-indol-3-yl)methyl]-1-piperidinyl]ethyl]-4,4-dimethyl-3H-isoquinolin-1-one IUPAC Name: 2-[2-[4-[(5-fluoro-1H-indol-3-yl)methyl]piperidin-1-yl]ethyl]-4,4-dimethyl-3H-isoquinolin-1-one Traditional Name: 2-[2-[4-[(5-fluoro-1H-indol-3-yl)methyl]piperidino]ethyl]-4,4-dimethyl-3H-isoquinolin-1-one Formula: C27H32FN3O MolecularWeight: 433.560883

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)C2=CC=CC=C21)CCN3CCC(CC3)CC4=CNC5=C4C=C(C=C5)F)C

Isomeric SMILES

CC1(CN(C(=O)C2=CC=CC=C21)CCN3CCC(CC3)CC4=CNC5=C4C=C(C=C5)F)C

InChI

InChI=1S/C27H32FN3O/c1-27(2)18-31(26(32)22-5-3-4-6-24(22)27)14-13-30-11-9-19(10-12-30)15-20-17-29-25-8-7-21(28)16-23(20)25/h3-8,16-17,19,29H,9-15,18H2,1-2H3