(3-methylphenyl)-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-methylphenyl)-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: m-tolyl-[4-(p-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (3-methylphenyl)-[4-[(4-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3-methylphenyl)-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: [4-(4-methylbenzyl)piperazin-4-ium-1-yl]-(m-tolyl)methanone Formula: C20H25N2O+ MolecularWeight: 309.4253

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O/c1-16-6-8-18(9-7-16)15-21-10-12-22(13-11-21)20(23)19-5-3-4-17(2)14-19/h3-9,14H,10-13,15H2,1-2H3/p+1