2-[1-[(4-fluoranyl-3-methoxy-phenyl)methyl]piperidin-3-yl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[1-[(4-fluoranyl-3-methoxy-phenyl)methyl]piperidin-3-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[1-[(4-fluoro-3-methoxy-phenyl)methyl]-3-piperidyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[1-[(4-fluoro-3-methoxyphenyl)methyl]-3-piperidinyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[1-[(4-fluoro-3-methoxyphenyl)methyl]piperidin-3-yl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[1-(4-fluoro-3-methoxy-benzyl)-3-piperidyl]-3,4-dihydro-1H-isoquinoline Formula: C22H27FN2O MolecularWeight: 354.460983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CCCC(C2)N3CCC4=CC=CC=C4C3)F

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CCCC(C2)N3CCC4=CC=CC=C4C3)F

InChI

InChI=1S/C22H27FN2O/c1-26-22-13-17(8-9-21(22)23)14-24-11-4-7-20(16-24)25-12-10-18-5-2-3-6-19(18)15-25/h2-3,5-6,8-9,13,20H,4,7,10-12,14-16H2,1H3