2-[4-[2-(2-tert-butyl-6-methyl-phenoxy)ethoxy]-3-chloranyl-5-methoxy-phenyl]ethylazanium

Systemtic Name: 2-[4-[2-(2-tert-butyl-6-methyl-phenoxy)ethoxy]-3-chloranyl-5-methoxy-phenyl]ethylazanium Openeye Name: 2-[4-[2-(2-tert-butyl-6-methyl-phenoxy)ethoxy]-3-chloro-5-methoxy-phenyl]ethylammonium CAS Name: 2-[4-[2-(2-tert-butyl-6-methylphenoxy)ethoxy]-3-chloro-5-methoxyphenyl]ethylammonium IUPAC Name: 2-[4-[2-(2-tert-butyl-6-methylphenoxy)ethoxy]-3-chloro-5-methoxyphenyl]ethylazanium Traditional Name: 2-[4-[2-(2-tert-butyl-6-methyl-phenoxy)ethoxy]-3-chloro-5-methoxy-phenyl]ethylammonium Formula: C22H31ClNO3+ MolecularWeight: 392.93944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30ClNO3/c1-15-7-6-8-17(22(2,3)4)20(15)26-11-12-27-21-18(23)13-16(9-10-24)14-19(21)25-5/h6-8,13-14H,9-12,24H2,1-5H3/p+1