3-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenoxy]but-3-en-2-one

Systemtic Name: 3-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenoxy]but-3-en-2-one Openeye Name: 3-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]phenoxy]but-3-en-2-one CAS Name: 3-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenoxy]-3-buten-2-one IUPAC Name: 3-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenoxy]but-3-en-2-one Traditional Name: 3-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]phenoxy]but-3-en-2-one Formula: C17H25NO4 MolecularWeight: 307.3847

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C)OC1=CC=C(C=C1)OCC(CNC(C)(C)C)O

Isomeric SMILES

CC(=O)C(=C)OC1=CC=C(C=C1)OCC(CNC(C)(C)C)O

InChI

InChI=1S/C17H25NO4/c1-12(19)13(2)22-16-8-6-15(7-9-16)21-11-14(20)10-18-17(3,4)5/h6-9,14,18,20H,2,10-11H2,1,3-5H3