3-butoxypropyl-[[3-chloranyl-4-[(2,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl]azanium

Systemtic Name: 3-butoxypropyl-[[3-chloranyl-4-[(2,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl]azanium Openeye Name: 3-butoxypropyl-[[3-chloro-4-[(2,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl]ammonium CAS Name: 3-butoxypropyl-[[3-chloro-4-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methyl]ammonium IUPAC Name: 3-butoxypropyl-[[3-chloro-4-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methyl]azanium Traditional Name: 3-butoxypropyl-[3-chloro-4-(2,4-dichlorobenzyl)oxy-5-methoxy-benzyl]ammonium Formula: C22H29Cl3NO3+ MolecularWeight: 461.82956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28Cl3NO3/c1-3-4-9-28-10-5-8-26-14-16-11-20(25)22(21(12-16)27-2)29-15-17-6-7-18(23)13-19(17)24/h6-7,11-13,26H,3-5,8-10,14-15H2,1-2H3/p+1