[3-bromanyl-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-(3-methoxypropyl)azanium

Systemtic Name: [3-bromanyl-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-(3-methoxypropyl)azanium Openeye Name: [3-bromo-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-(3-methoxypropyl)ammonium CAS Name: [3-bromo-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl-(3-methoxypropyl)ammonium IUPAC Name: [3-bromo-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl-(3-methoxypropyl)azanium Traditional Name: [3-bromo-4-(2-chlorobenzyl)oxy-5-ethoxy-benzyl]-(3-methoxypropyl)ammonium Formula: C20H26BrClNO3+ MolecularWeight: 443.78234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CCCOC)Br)OCC2=CC=CC=C2Cl

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CCCOC)Br)OCC2=CC=CC=C2Cl

InChI

InChI=1S/C20H25BrClNO3/c1-3-25-19-12-15(13-23-9-6-10-24-2)11-17(21)20(19)26-14-16-7-4-5-8-18(16)22/h4-5,7-8,11-12,23H,3,6,9-10,13-14H2,1-2H3/p+1