[3-[2-(2-tert-butyl-6-methyl-phenoxy)ethoxy]-4-methoxy-phenyl]methylazanium

Systemtic Name: [3-[2-(2-tert-butyl-6-methyl-phenoxy)ethoxy]-4-methoxy-phenyl]methylazanium Openeye Name: [3-[2-(2-tert-butyl-6-methyl-phenoxy)ethoxy]-4-methoxy-phenyl]methylammonium CAS Name: [3-[2-(2-tert-butyl-6-methylphenoxy)ethoxy]-4-methoxyphenyl]methylammonium IUPAC Name: [3-[2-(2-tert-butyl-6-methylphenoxy)ethoxy]-4-methoxyphenyl]methylazanium Traditional Name: [3-[2-(2-tert-butyl-6-methyl-phenoxy)ethoxy]-4-methoxy-benzyl]ammonium Formula: C21H30NO3+ MolecularWeight: 344.4678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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