2-[5-chloranyl-2-(octadecylamino)-4-oxidanyl-phenoxy]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[5-chloranyl-2-(octadecylamino)-4-oxidanyl-phenoxy]-N-propan-2-yl-ethanamide Openeye Name: 2-[5-chloro-4-hydroxy-2-(octadecylamino)phenoxy]-N-isopropyl-acetamide CAS Name: 2-[5-chloro-4-hydroxy-2-(octadecylamino)phenoxy]-N-propan-2-ylacetamide IUPAC Name: 2-[5-chloro-4-hydroxy-2-(octadecylamino)phenoxy]-N-propan-2-ylacetamide Traditional Name: 2-[5-chloro-4-hydroxy-2-(stearylamino)phenoxy]-N-isopropyl-acetamide Formula: C29H51ClN2O3 MolecularWeight: 511.17984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC1=CC(=C(C=C1OCC(=O)NC(C)C)Cl)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC1=CC(=C(C=C1OCC(=O)NC(C)C)Cl)O

InChI

InChI=1S/C29H51ClN2O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-31-26-22-27(33)25(30)21-28(26)35-23-29(34)32-24(2)3/h21-22,24,31,33H,4-20,23H2,1-3H3,(H,32,34)