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

Systemtic Name: 3-ethoxypropyl-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: 3-ethoxypropyl-[[3-methoxy-4-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: 3-ethoxypropyl-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 3-ethoxypropyl-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: 3-ethoxypropyl-[3-methoxy-4-(4-methylbenzyl)oxy-benzyl]ammonium Formula: C21H30NO3+ MolecularWeight: 344.4678

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC[NH2+]CC1=CC(=C(C=C1)OCC2=CC=C(C=C2)C)OC

Isomeric SMILES

CCOCCC[NH2+]CC1=CC(=C(C=C1)OCC2=CC=C(C=C2)C)OC

InChI

InChI=1S/C21H29NO3/c1-4-24-13-5-12-22-15-19-10-11-20(21(14-19)23-3)25-16-18-8-6-17(2)7-9-18/h6-11,14,22H,4-5,12-13,15-16H2,1-3H3/p+1