(2S)-2-azanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)butan-1-one

Systemtic Name: (2S)-2-azanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)butan-1-one Openeye Name: (2S)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)butan-1-one CAS Name: (2S)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-butanone IUPAC Name: (2S)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)butan-1-one Traditional Name: (2S)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)butan-1-one Formula: C12H15NO3 MolecularWeight: 221.2524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC2=C(C=C1)OCCO2)N

Isomeric SMILES

CC[C@@H](C(=O)C1=CC2=C(C=C1)OCCO2)N

InChI

InChI=1S/C12H15NO3/c1-2-9(13)12(14)8-3-4-10-11(7-8)16-6-5-15-10/h3-4,7,9H,2,5-6,13H2,1H3/t9-/m0/s1