[4-[(2,4-dichlorophenyl)methoxy]-3-ethoxy-phenyl]methyl-(3-ethoxypropyl)azanium

Systemtic Name: [4-[(2,4-dichlorophenyl)methoxy]-3-ethoxy-phenyl]methyl-(3-ethoxypropyl)azanium Openeye Name: [4-[(2,4-dichlorophenyl)methoxy]-3-ethoxy-phenyl]methyl-(3-ethoxypropyl)ammonium CAS Name: [4-[(2,4-dichlorophenyl)methoxy]-3-ethoxyphenyl]methyl-(3-ethoxypropyl)ammonium IUPAC Name: [4-[(2,4-dichlorophenyl)methoxy]-3-ethoxyphenyl]methyl-(3-ethoxypropyl)azanium Traditional Name: [4-(2,4-dichlorobenzyl)oxy-3-ethoxy-benzyl]-(3-ethoxypropyl)ammonium Formula: C21H28Cl2NO3+ MolecularWeight: 413.35792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27Cl2NO3/c1-3-25-11-5-10-24-14-16-6-9-20(21(12-16)26-4-2)27-15-17-7-8-18(22)13-19(17)23/h6-9,12-13,24H,3-5,10-11,14-15H2,1-2H3/p+1