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

Systemtic Name: [2-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]methyl-(3-ethoxypropyl)azanium Openeye Name: [2-[(2-chloro-4-fluoro-phenyl)methoxy]-3-methoxy-phenyl]methyl-(3-ethoxypropyl)ammonium CAS Name: [2-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(3-ethoxypropyl)ammonium IUPAC Name: [2-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(3-ethoxypropyl)azanium Traditional Name: [2-(2-chloro-4-fluoro-benzyl)oxy-3-methoxy-benzyl]-(3-ethoxypropyl)ammonium Formula: C20H26ClFNO3+ MolecularWeight: 382.876743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClFNO3/c1-3-25-11-5-10-23-13-15-6-4-7-19(24-2)20(15)26-14-16-8-9-17(22)12-18(16)21/h4,6-9,12,23H,3,5,10-11,13-14H2,1-2H3/p+1