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

Systemtic Name: 3-ethoxypropyl-[[3-methoxy-4-[(2-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: 3-ethoxypropyl-[[3-methoxy-4-(o-tolylmethoxy)phenyl]methyl]ammonium CAS Name: 3-ethoxypropyl-[[3-methoxy-4-[(2-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 3-ethoxypropyl-[[3-methoxy-4-[(2-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: 3-ethoxypropyl-[3-methoxy-4-(2-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=CC=C2C)OC

Isomeric SMILES

CCOCCC[NH2+]CC1=CC(=C(C=C1)OCC2=CC=CC=C2C)OC

InChI

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