6-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methylidene]-2-ethoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methylidene]-2-ethoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methylene]-2-ethoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methylidene]-2-ethoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methylidene]-2-ethoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methylene]-2-ethoxy-cyclohexa-2,4-dien-1-one Formula: C18H19NO4 MolecularWeight: 313.34776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=CNCC2COC3=CC=CC=C3O2)C1=O

Isomeric SMILES

CCOC1=CC=CC(=CNC[C@H]2COC3=CC=CC=C3O2)C1=O

InChI

InChI=1S/C18H19NO4/c1-2-21-17-9-5-6-13(18(17)20)10-19-11-14-12-22-15-7-3-4-8-16(15)23-14/h3-10,14,19H,2,11-12H2,1H3/t14-/m0/s1