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

Systemtic Name: 2-[4-[2-(2-tert-butyl-4-methyl-phenoxy)ethoxy]-3-chloranyl-5-methoxy-phenyl]ethanamine Openeye Name: 2-[4-[2-(2-tert-butyl-4-methyl-phenoxy)ethoxy]-3-chloro-5-methoxy-phenyl]ethanamine CAS Name: 2-[4-[2-(2-tert-butyl-4-methylphenoxy)ethoxy]-3-chloro-5-methoxyphenyl]ethanamine IUPAC Name: 2-[4-[2-(2-tert-butyl-4-methylphenoxy)ethoxy]-3-chloro-5-methoxyphenyl]ethanamine Traditional Name: 2-[4-[2-(2-tert-butyl-4-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=CC(=C(C=C1)OCCOC2=C(C=C(C=C2Cl)CCN)OC)C(C)(C)C

Isomeric SMILES

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

InChI

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