4-[3,4-dimethyl-4-(3-methylphenyl)piperazin-4-ium-1-yl]aniline chloride

Systemtic Name: 4-[3,4-dimethyl-4-(3-methylphenyl)piperazin-4-ium-1-yl]aniline chloride Openeye Name: 4-[3,4-dimethyl-4-(m-tolyl)piperazin-4-ium-1-yl]aniline chloride CAS Name: 4-[3,4-dimethyl-4-(3-methylphenyl)-1-piperazin-4-iumyl]aniline chloride IUPAC Name: 4-[3,4-dimethyl-4-(3-methylphenyl)piperazin-4-ium-1-yl]aniline chloride Traditional Name: [4-[3,4-dimethyl-4-(m-tolyl)piperazin-4-ium-1-yl]phenyl]amine chloride Formula: C19H26ClN3 MolecularWeight: 331.88284

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC[N+]1(C)C2=CC=CC(=C2)C)C3=CC=C(C=C3)N.[Cl-]

Isomeric SMILES

CC1CN(CC[N+]1(C)C2=CC=CC(=C2)C)C3=CC=C(C=C3)N.[Cl-]

InChI

InChI=1S/C19H26N3.ClH/c1-15-5-4-6-19(13-15)22(3)12-11-21(14-16(22)2)18-9-7-17(20)8-10-18;/h4-10,13,16H,11-12,14,20H2,1-3H3;1H/q+1;/p-1