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

Systemtic Name: [4-[[4-(3-methylphenyl)piperazin-1-ium-1-yl]methyl]phenyl]methylazanium Openeye Name: [4-[[4-(m-tolyl)piperazin-1-ium-1-yl]methyl]phenyl]methylammonium CAS Name: [4-[[4-(3-methylphenyl)-1-piperazin-1-iumyl]methyl]phenyl]methylammonium IUPAC Name: [4-[[4-(3-methylphenyl)piperazin-1-ium-1-yl]methyl]phenyl]methylazanium Traditional Name: [4-[[4-(m-tolyl)piperazin-1-ium-1-yl]methyl]benzyl]ammonium Formula: C19H27N3+2 MolecularWeight: 297.43778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CC3=CC=C(C=C3)C[NH3+]

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CC3=CC=C(C=C3)C[NH3+]

InChI

InChI=1S/C19H25N3/c1-16-3-2-4-19(13-16)22-11-9-21(10-12-22)15-18-7-5-17(14-20)6-8-18/h2-8,13H,9-12,14-15,20H2,1H3/p+2