1-[4-(2-fluoranylethyl)piperazin-1-yl]-3-(4-methoxyphenyl)isoquinoline

Systemtic Name: 1-[4-(2-fluoranylethyl)piperazin-1-yl]-3-(4-methoxyphenyl)isoquinoline Openeye Name: 1-[4-(2-fluoroethyl)piperazin-1-yl]-3-(4-methoxyphenyl)isoquinoline CAS Name: 1-[4-(2-fluoroethyl)-1-piperazinyl]-3-(4-methoxyphenyl)isoquinoline IUPAC Name: 1-[4-(2-fluoroethyl)piperazin-1-yl]-3-(4-methoxyphenyl)isoquinoline Traditional Name: 1-[4-(2-fluoroethyl)piperazino]-3-(4-methoxyphenyl)isoquinoline Formula: C22H24FN3O MolecularWeight: 365.443863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCN(CC4)CCF

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCN(CC4)CCF

InChI

InChI=1S/C22H24FN3O/c1-27-19-8-6-17(7-9-19)21-16-18-4-2-3-5-20(18)22(24-21)26-14-12-25(11-10-23)13-15-26/h2-9,16H,10-15H2,1H3