4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]piperidin-1-ium

Systemtic Name: 4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]piperidin-1-ium Openeye Name: 4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]piperidin-1-ium CAS Name: 4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]piperidin-1-ium IUPAC Name: 4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]piperidin-1-ium Traditional Name: 4-[4-(3,4-dimethylbenzyl)benzyl]piperidin-1-ium Formula: C21H28N+ MolecularWeight: 294.45372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2=CC=C(C=C2)CC3CC[NH2+]CC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)CC2=CC=C(C=C2)CC3CC[NH2+]CC3)C

InChI

InChI=1S/C21H27N/c1-16-3-4-21(13-17(16)2)15-19-7-5-18(6-8-19)14-20-9-11-22-12-10-20/h3-8,13,20,22H,9-12,14-15H2,1-2H3/p+1