2-[4-[(2S)-3-(2-morpholin-4-ylethylamino)-2-oxidanyl-propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[(2S)-3-(2-morpholin-4-ylethylamino)-2-oxidanyl-propoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[(2S)-2-hydroxy-3-(2-morpholinoethylamino)propoxy]phenyl]acetonitrile CAS Name: 2-[4-[(2S)-2-hydroxy-3-[2-(4-morpholinyl)ethylamino]propoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[(2S)-2-hydroxy-3-(2-morpholin-4-ylethylamino)propoxy]phenyl]acetonitrile Traditional Name: 2-[4-[(2S)-2-hydroxy-3-(2-morpholinoethylamino)propoxy]phenyl]acetonitrile Formula: C17H25N3O3 MolecularWeight: 319.3987

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNCC(COC2=CC=C(C=C2)CC#N)O

Isomeric SMILES

C1COCCN1CCNC[C@@H](COC2=CC=C(C=C2)CC#N)O

InChI

InChI=1S/C17H25N3O3/c18-6-5-15-1-3-17(4-2-15)23-14-16(21)13-19-7-8-20-9-11-22-12-10-20/h1-4,16,19,21H,5,7-14H2/t16-/m0/s1