4-(4-chloranyl-2,3-dimethyl-phenoxy)butyl-methyl-(phenylmethyl)azanium

Systemtic Name: 4-(4-chloranyl-2,3-dimethyl-phenoxy)butyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[4-(4-chloro-2,3-dimethyl-phenoxy)butyl]-methyl-ammonium CAS Name: 4-(4-chloro-2,3-dimethylphenoxy)butyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[4-(4-chloro-2,3-dimethylphenoxy)butyl]-methylazanium Traditional Name: benzyl-[4-(4-chloro-2,3-dimethyl-phenoxy)butyl]-methyl-ammonium Formula: C20H27ClNO+ MolecularWeight: 332.88748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)Cl)OCCCC[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1C)Cl)OCCCC[NH+](C)CC2=CC=CC=C2

InChI

InChI=1S/C20H26ClNO/c1-16-17(2)20(12-11-19(16)21)23-14-8-7-13-22(3)15-18-9-5-4-6-10-18/h4-6,9-12H,7-8,13-15H2,1-3H3/p+1