[4-[2-(2-tert-butyl-5-methyl-phenoxy)ethoxy]-3-methoxy-phenyl]methylazanium

Systemtic Name: [4-[2-(2-tert-butyl-5-methyl-phenoxy)ethoxy]-3-methoxy-phenyl]methylazanium Openeye Name: [4-[2-(2-tert-butyl-5-methyl-phenoxy)ethoxy]-3-methoxy-phenyl]methylammonium CAS Name: [4-[2-(2-tert-butyl-5-methylphenoxy)ethoxy]-3-methoxyphenyl]methylammonium IUPAC Name: [4-[2-(2-tert-butyl-5-methylphenoxy)ethoxy]-3-methoxyphenyl]methylazanium Traditional Name: [4-[2-(2-tert-butyl-5-methyl-phenoxy)ethoxy]-3-methoxy-benzyl]ammonium Formula: C21H30NO3+ MolecularWeight: 344.4678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)OCCOC2=C(C=C(C=C2)C[NH3+])OC

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)OCCOC2=C(C=C(C=C2)C[NH3+])OC

InChI

InChI=1S/C21H29NO3/c1-15-6-8-17(21(2,3)4)19(12-15)25-11-10-24-18-9-7-16(14-22)13-20(18)23-5/h6-9,12-13H,10-11,14,22H2,1-5H3/p+1