N-[5-[2,4-bis(2-methylbutan-2-yl)phenoxy]-2-chloranyl-4-methoxy-phenyl]-2-bromanyl-ethanamide; 2-methylazetidine

Systemtic Name: N-[5-[2,4-bis(2-methylbutan-2-yl)phenoxy]-2-chloranyl-4-methoxy-phenyl]-2-bromanyl-ethanamide; 2-methylazetidine Openeye Name: N-[5-[2,4-bis(1,1-dimethylpropyl)phenoxy]-2-chloro-4-methoxy-phenyl]-2-bromo-acetamide; 2-methylazetidine CAS Name: N-[5-[2,4-bis(2-methylbutan-2-yl)phenoxy]-2-chloro-4-methoxyphenyl]-2-bromoacetamide; 2-methylazetidine IUPAC Name: N-[5-[2,4-bis(2-methylbutan-2-yl)phenoxy]-2-chloro-4-methoxyphenyl]-2-bromoacetamide; 2-methylazetidine Traditional Name: 2-bromo-N-[2-chloro-5-(2,4-ditert-amylphenoxy)-4-methoxy-phenyl]acetamide; 2-methylazetidine Formula: C29H42BrClN2O3 MolecularWeight: 582.01238

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C=C(C(=C2)NC(=O)CBr)Cl)OC)C(C)(C)CC.CC1CCN1

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C=C(C(=C2)NC(=O)CBr)Cl)OC)C(C)(C)CC.CC1CCN1

InChI

InChI=1S/C25H33BrClNO3.C4H9N/c1-8-24(3,4)16-10-11-20(17(12-16)25(5,6)9-2)31-22-14-19(28-23(29)15-26)18(27)13-21(22)30-7;1-4-2-3-5-4/h10-14H,8-9,15H2,1-7H3,(H,28,29);4-5H,2-3H2,1H3