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

Systemtic Name: 3-ethoxypropyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: 3-ethoxypropyl-[[3-methoxy-2-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: 3-ethoxypropyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 3-ethoxypropyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: 3-ethoxypropyl-[3-methoxy-2-(4-methylbenzyl)oxy-benzyl]ammonium Formula: C21H30NO3+ MolecularWeight: 344.4678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO3/c1-4-24-14-6-13-22-15-19-7-5-8-20(23-3)21(19)25-16-18-11-9-17(2)10-12-18/h5,7-12,22H,4,6,13-16H2,1-3H3/p+1