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

Systemtic Name: (4-methoxyphenyl)-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (4-methoxyphenyl)-[4-(m-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (4-methoxyphenyl)-[4-[(3-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (4-methoxyphenyl)-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (4-methoxyphenyl)-[4-(3-methylbenzyl)piperazin-4-ium-1-yl]methanone Formula: C20H25N2O2+ MolecularWeight: 325.4247

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O2/c1-16-4-3-5-17(14-16)15-21-10-12-22(13-11-21)20(23)18-6-8-19(24-2)9-7-18/h3-9,14H,10-13,15H2,1-2H3/p+1