N-[3-cyano-4-[3-(2-methylbut-3-yn-2-ylamino)-2-oxidanyl-propoxy]phenyl]-2-methyl-propanamide

Systemtic Name: N-[3-cyano-4-[3-(2-methylbut-3-yn-2-ylamino)-2-oxidanyl-propoxy]phenyl]-2-methyl-propanamide Openeye Name: N-[3-cyano-4-[3-(1,1-dimethylprop-2-ynylamino)-2-hydroxy-propoxy]phenyl]-2-methyl-propanamide CAS Name: N-[3-cyano-4-[2-hydroxy-3-(2-methylbut-3-yn-2-ylamino)propoxy]phenyl]-2-methylpropanamide IUPAC Name: N-[3-cyano-4-[2-hydroxy-3-(2-methylbut-3-yn-2-ylamino)propoxy]phenyl]-2-methylpropanamide Traditional Name: N-[3-cyano-4-[3-(1,1-dimethylprop-2-ynylamino)-2-hydroxy-propoxy]phenyl]-2-methyl-propionamide Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C#C)O)C#N

Isomeric SMILES

CC(C)C(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C#C)O)C#N

InChI

InChI=1S/C19H25N3O3/c1-6-19(4,5)21-11-16(23)12-25-17-8-7-15(9-14(17)10-20)22-18(24)13(2)3/h1,7-9,13,16,21,23H,11-12H2,2-5H3,(H,22,24)