2-methyl-3-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]aniline

Systemtic Name: 2-methyl-3-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]aniline Openeye Name: 3-[(4-benzylpiperazin-1-ium-1-yl)methyl]-2-methyl-aniline CAS Name: 2-methyl-3-[[4-(phenylmethyl)-1-piperazin-1-iumyl]methyl]aniline IUPAC Name: 3-[(4-benzylpiperazin-1-ium-1-yl)methyl]-2-methylaniline Traditional Name: [3-[(4-benzylpiperazin-1-ium-1-yl)methyl]-2-methyl-phenyl]amine Formula: C19H26N3+ MolecularWeight: 296.42984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N)C[NH+]2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1N)C[NH+]2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H25N3/c1-16-18(8-5-9-19(16)20)15-22-12-10-21(11-13-22)14-17-6-3-2-4-7-17/h2-9H,10-15,20H2,1H3/p+1