[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-hexyl-azanium

Systemtic Name: [4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-hexyl-azanium Openeye Name: [4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-hexyl-ammonium CAS Name: [4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methyl-hexylammonium IUPAC Name: [4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methyl-hexylazanium Traditional Name: [4-(4-chlorobenzyl)oxy-3-methoxy-benzyl]-hexyl-ammonium Formula: C21H29ClNO2+ MolecularWeight: 362.91346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28ClNO2/c1-3-4-5-6-13-23-15-18-9-12-20(21(14-18)24-2)25-16-17-7-10-19(22)11-8-17/h7-12,14,23H,3-6,13,15-16H2,1-2H3/p+1