6-methyl-8-[[4-(phenylmethyl)piperazin-4-ium-1-yl]methyl]quinoline

Systemtic Name: 6-methyl-8-[[4-(phenylmethyl)piperazin-4-ium-1-yl]methyl]quinoline Openeye Name: 8-[(4-benzylpiperazin-4-ium-1-yl)methyl]-6-methyl-quinoline CAS Name: 6-methyl-8-[[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]quinoline IUPAC Name: 8-[(4-benzylpiperazin-4-ium-1-yl)methyl]-6-methylquinoline Traditional Name: 8-[(4-benzylpiperazin-4-ium-1-yl)methyl]-6-methyl-quinoline Formula: C22H26N3+ MolecularWeight: 332.46194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=CC=N2)CN3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C2C(=C1)C=CC=N2)CN3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H25N3/c1-18-14-20-8-5-9-23-22(20)21(15-18)17-25-12-10-24(11-13-25)16-19-6-3-2-4-7-19/h2-9,14-15H,10-13,16-17H2,1H3/p+1