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

Systemtic Name: 4-[[4-[(3-methylphenyl)methyl]phenyl]methyl]piperidin-1-ium Openeye Name: 4-[[4-(m-tolylmethyl)phenyl]methyl]piperidin-1-ium CAS Name: 4-[[4-[(3-methylphenyl)methyl]phenyl]methyl]piperidin-1-ium IUPAC Name: 4-[[4-[(3-methylphenyl)methyl]phenyl]methyl]piperidin-1-ium Traditional Name: 4-[4-(3-methylbenzyl)benzyl]piperidin-1-ium Formula: C20H26N+ MolecularWeight: 280.42714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N/c1-16-3-2-4-20(13-16)15-18-7-5-17(6-8-18)14-19-9-11-21-12-10-19/h2-8,13,19,21H,9-12,14-15H2,1H3/p+1