1,1-diethyl-8-methyl-4-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-4H-quinolin-1-ium

Systemtic Name: 1,1-diethyl-8-methyl-4-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-4H-quinolin-1-ium Openeye Name: 1,1-diethyl-8-methyl-4-[4-(p-tolylmethyl)piperazin-1-yl]-4H-quinolin-1-ium CAS Name: 1,1-diethyl-8-methyl-4-[4-[(4-methylphenyl)methyl]-1-piperazinyl]-4H-quinolin-1-ium IUPAC Name: 1,1-diethyl-8-methyl-4-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-4H-quinolin-1-ium Traditional Name: 1,1-diethyl-8-methyl-4-[4-(4-methylbenzyl)piperazino]-4H-quinolin-1-ium Formula: C26H36N3+ MolecularWeight: 390.58414

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C=CC(C2=C1C(=CC=C2)C)N3CCN(CC3)CC4=CC=C(C=C4)C)CC

Isomeric SMILES

CC[N+]1(C=CC(C2=C1C(=CC=C2)C)N3CCN(CC3)CC4=CC=C(C=C4)C)CC

InChI

InChI=1S/C26H36N3/c1-5-29(6-2)19-14-25(24-9-7-8-22(4)26(24)29)28-17-15-27(16-18-28)20-23-12-10-21(3)11-13-23/h7-14,19,25H,5-6,15-18,20H2,1-4H3/q+1