4-[4-[(3,4-dimethylphenyl)methyl]piperazin-4-ium-1-yl]aniline

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C[NH+]2CCN(CC2)C3=CC=C(C=C3)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C[NH+]2CCN(CC2)C3=CC=C(C=C3)N)C

InChI

InChI=1S/C19H25N3/c1-15-3-4-17(13-16(15)2)14-21-9-11-22(12-10-21)19-7-5-18(20)6-8-19/h3-8,13H,9-12,14,20H2,1-2H3/p+1