3-imidazol-1-ylpropyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]azanium

Systemtic Name: 3-imidazol-1-ylpropyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: 3-imidazol-1-ylpropyl-[[3-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: 3-(1-imidazolyl)propyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 3-imidazol-1-ylpropyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: 3-imidazol-1-ylpropyl-[3-(4-methylbenzyl)oxybenzyl]ammonium Formula: C21H26N3O+ MolecularWeight: 336.45064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC=CC(=C2)C[NH2+]CCCN3C=CN=C3

Isomeric SMILES

CC1=CC=C(C=C1)COC2=CC=CC(=C2)C[NH2+]CCCN3C=CN=C3

InChI

InChI=1S/C21H25N3O/c1-18-6-8-19(9-7-18)16-25-21-5-2-4-20(14-21)15-22-10-3-12-24-13-11-23-17-24/h2,4-9,11,13-14,17,22H,3,10,12,15-16H2,1H3/p+1