[4-[[4-(4-methylphenyl)phenoxy]methyl]phenyl]methylazanium

Systemtic Name: [4-[[4-(4-methylphenyl)phenoxy]methyl]phenyl]methylazanium Openeye Name: [4-[[4-(p-tolyl)phenoxy]methyl]phenyl]methylammonium CAS Name: [4-[[4-(4-methylphenyl)phenoxy]methyl]phenyl]methylammonium IUPAC Name: [4-[[4-(4-methylphenyl)phenoxy]methyl]phenyl]methylazanium Traditional Name: [4-[[4-(p-tolyl)phenoxy]methyl]benzyl]ammonium Formula: C21H22NO+ MolecularWeight: 304.40548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C[NH3+]

InChI

InChI=1S/C21H21NO/c1-16-2-8-19(9-3-16)20-10-12-21(13-11-20)23-15-18-6-4-17(14-22)5-7-18/h2-13H,14-15,22H2,1H3/p+1