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

Systemtic Name: [3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(2-methylpropyl)azanium Openeye Name: [3-ethoxy-4-(p-tolylmethoxy)phenyl]methyl-isobutyl-ammonium CAS Name: [3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(2-methylpropyl)ammonium IUPAC Name: [3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(2-methylpropyl)azanium Traditional Name: [3-ethoxy-4-(4-methylbenzyl)oxy-benzyl]-isobutyl-ammonium Formula: C21H30NO2+ MolecularWeight: 328.4684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CC(C)C)OCC2=CC=C(C=C2)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CC(C)C)OCC2=CC=C(C=C2)C

InChI

InChI=1S/C21H29NO2/c1-5-23-21-12-19(14-22-13-16(2)3)10-11-20(21)24-15-18-8-6-17(4)7-9-18/h6-12,16,22H,5,13-15H2,1-4H3/p+1