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

Systemtic Name: [3-bromanyl-4-[(2-chlorophenyl)methoxy]-5-methoxy-phenyl]methyl-pentyl-azanium Openeye Name: [3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxy-phenyl]methyl-pentyl-ammonium CAS Name: [3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methyl-pentylammonium IUPAC Name: [3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methyl-pentylazanium Traditional Name: amyl-[3-bromo-4-(2-chlorobenzyl)oxy-5-methoxy-benzyl]ammonium Formula: C20H26BrClNO2+ MolecularWeight: 427.78294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH2+]CC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2Cl)OC

Isomeric SMILES

CCCCC[NH2+]CC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2Cl)OC

InChI

InChI=1S/C20H25BrClNO2/c1-3-4-7-10-23-13-15-11-17(21)20(19(12-15)24-2)25-14-16-8-5-6-9-18(16)22/h5-6,8-9,11-12,23H,3-4,7,10,13-14H2,1-2H3/p+1