[4-methoxy-3-[(3-methylphenyl)methoxy]phenyl]methyl-(2-methylpropyl)azanium

Systemtic Name: [4-methoxy-3-[(3-methylphenyl)methoxy]phenyl]methyl-(2-methylpropyl)azanium Openeye Name: isobutyl-[[4-methoxy-3-(m-tolylmethoxy)phenyl]methyl]ammonium CAS Name: [4-methoxy-3-[(3-methylphenyl)methoxy]phenyl]methyl-(2-methylpropyl)ammonium IUPAC Name: [4-methoxy-3-[(3-methylphenyl)methoxy]phenyl]methyl-(2-methylpropyl)azanium Traditional Name: isobutyl-[4-methoxy-3-(3-methylbenzyl)oxy-benzyl]ammonium Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=C(C=CC(=C2)C[NH2+]CC(C)C)OC

Isomeric SMILES

CC1=CC(=CC=C1)COC2=C(C=CC(=C2)C[NH2+]CC(C)C)OC

InChI

InChI=1S/C20H27NO2/c1-15(2)12-21-13-17-8-9-19(22-4)20(11-17)23-14-18-7-5-6-16(3)10-18/h5-11,15,21H,12-14H2,1-4H3/p+1