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

Systemtic Name: 2-[4-[2-(2-tert-butyl-6-methyl-phenoxy)ethoxy]-3-chloranyl-5-methoxy-phenyl]ethanamine Openeye Name: 2-[4-[2-(2-tert-butyl-6-methyl-phenoxy)ethoxy]-3-chloro-5-methoxy-phenyl]ethanamine CAS Name: 2-[4-[2-(2-tert-butyl-6-methylphenoxy)ethoxy]-3-chloro-5-methoxyphenyl]ethanamine IUPAC Name: 2-[4-[2-(2-tert-butyl-6-methylphenoxy)ethoxy]-3-chloro-5-methoxyphenyl]ethanamine Traditional Name: 2-[4-[2-(2-tert-butyl-6-methyl-phenoxy)ethoxy]-3-chloro-5-methoxy-phenyl]ethylamine Formula: C22H30ClNO3 MolecularWeight: 391.9315

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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)CCN)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)(C)C)OCCOC2=C(C=C(C=C2Cl)CCN)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