[4-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethoxy]-3-methoxy-phenyl]methylazanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCOC2=C(C=C(C=C2)C[NH3+])OC

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCOC2=C(C=C(C=C2)C[NH3+])OC

InChI

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