2-[4-bromanyl-2-[(heptylamino)methyl]phenoxy]-N-tert-butyl-ethanamide

Systemtic Name: 2-[4-bromanyl-2-[(heptylamino)methyl]phenoxy]-N-tert-butyl-ethanamide Openeye Name: 2-[4-bromo-2-[(heptylamino)methyl]phenoxy]-N-tert-butyl-acetamide CAS Name: 2-[4-bromo-2-[(heptylamino)methyl]phenoxy]-N-tert-butylacetamide IUPAC Name: 2-[4-bromo-2-[(heptylamino)methyl]phenoxy]-N-tert-butylacetamide Traditional Name: 2-[4-bromo-2-[(heptylamino)methyl]phenoxy]-N-tert-butyl-acetamide Formula: C20H33BrN2O2 MolecularWeight: 413.39222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNCC1=C(C=CC(=C1)Br)OCC(=O)NC(C)(C)C

Isomeric SMILES

CCCCCCCNCC1=C(C=CC(=C1)Br)OCC(=O)NC(C)(C)C

InChI

InChI=1S/C20H33BrN2O2/c1-5-6-7-8-9-12-22-14-16-13-17(21)10-11-18(16)25-15-19(24)23-20(2,3)4/h10-11,13,22H,5-9,12,14-15H2,1-4H3,(H,23,24)