N,N-dimethyl-4-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]aniline

Systemtic Name: N,N-dimethyl-4-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]aniline Openeye Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-N,N-dimethyl-aniline CAS Name: N,N-dimethyl-4-[[4-(phenylmethyl)-1-piperazin-1-iumyl]methyl]aniline IUPAC Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-N,N-dimethylaniline Traditional Name: [4-[(4-benzylpiperazin-1-ium-1-yl)methyl]phenyl]-dimethyl-amine Formula: C20H28N3+ MolecularWeight: 310.45642

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H27N3/c1-21(2)20-10-8-19(9-11-20)17-23-14-12-22(13-15-23)16-18-6-4-3-5-7-18/h3-11H,12-17H2,1-2H3/p+1