[3-chloranyl-4-[2-(2,6-dimethylphenoxy)ethoxy]-5-methoxy-phenyl]methylazanium

Systemtic Name: [3-chloranyl-4-[2-(2,6-dimethylphenoxy)ethoxy]-5-methoxy-phenyl]methylazanium Openeye Name: [3-chloro-4-[2-(2,6-dimethylphenoxy)ethoxy]-5-methoxy-phenyl]methylammonium CAS Name: [3-chloro-4-[2-(2,6-dimethylphenoxy)ethoxy]-5-methoxyphenyl]methylammonium IUPAC Name: [3-chloro-4-[2-(2,6-dimethylphenoxy)ethoxy]-5-methoxyphenyl]methylazanium Traditional Name: [3-chloro-4-[2-(2,6-dimethylphenoxy)ethoxy]-5-methoxy-benzyl]ammonium Formula: C18H23ClNO3+ MolecularWeight: 336.83312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCOC2=C(C=C(C=C2Cl)C[NH3+])OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCOC2=C(C=C(C=C2Cl)C[NH3+])OC

InChI

InChI=1S/C18H22ClNO3/c1-12-5-4-6-13(2)17(12)22-7-8-23-18-15(19)9-14(11-20)10-16(18)21-3/h4-6,9-10H,7-8,11,20H2,1-3H3/p+1