4-[4-[(4-tert-butylphenyl)methyl]piperazin-4-ium-1-yl]aniline

Systemtic Name: 4-[4-[(4-tert-butylphenyl)methyl]piperazin-4-ium-1-yl]aniline Openeye Name: 4-[4-[(4-tert-butylphenyl)methyl]piperazin-4-ium-1-yl]aniline CAS Name: 4-[4-[(4-tert-butylphenyl)methyl]-1-piperazin-4-iumyl]aniline IUPAC Name: 4-[4-[(4-tert-butylphenyl)methyl]piperazin-4-ium-1-yl]aniline Traditional Name: [4-[4-(4-tert-butylbenzyl)piperazin-4-ium-1-yl]phenyl]amine Formula: C21H30N3+ MolecularWeight: 324.483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3/c1-21(2,3)18-6-4-17(5-7-18)16-23-12-14-24(15-13-23)20-10-8-19(22)9-11-20/h4-11H,12-16,22H2,1-3H3/p+1