(6E)-6-[[2-(3-oxidanylpropylamino)ethylamino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[[2-(3-oxidanylpropylamino)ethylamino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[[2-(3-hydroxypropylamino)ethylamino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[[2-(3-hydroxypropylamino)ethylamino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[[2-(3-hydroxypropylamino)ethylamino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[[2-(3-hydroxypropylamino)ethylamino]methylene]cyclohexa-2,4-dien-1-one Formula: C12H18N2O2 MolecularWeight: 222.28352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CNCCNCCCO)C(=O)C=C1

Isomeric SMILES

C1=C/C(=C\NCCNCCCO)/C(=O)C=C1

InChI

InChI=1S/C12H18N2O2/c15-9-3-6-13-7-8-14-10-11-4-1-2-5-12(11)16/h1-2,4-5,10,13-15H,3,6-9H2/b11-10+