1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanone Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H27N3O2/c1-27-21-8-6-20(7-9-21)24-14-12-23(13-15-24)17-22(26)25-11-10-18-4-2-3-5-19(18)16-25/h2-9H,10-17H2,1H3/p+1