7-[3-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methylamino]propoxy]chromen-2-one

Systemtic Name: 7-[3-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methylamino]propoxy]chromen-2-one Openeye Name: 7-[3-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methylamino]propoxy]chromen-2-one CAS Name: 7-[3-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methylamino]propoxy]-1-benzopyran-2-one IUPAC Name: 7-[3-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methylamino]propoxy]chromen-2-one Traditional Name: 7-[3-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methylamino]propoxy]coumarin Formula: C22H23NO6 MolecularWeight: 397.42112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCC(O2)CNCCCOC3=CC4=C(C=C3)C=CC(=O)O4

Isomeric SMILES

COC1=CC2=C(C=C1)OCC(O2)CNCCCOC3=CC4=C(C=C3)C=CC(=O)O4

InChI

InChI=1S/C22H23NO6/c1-25-16-6-7-19-21(11-16)28-18(14-27-19)13-23-9-2-10-26-17-5-3-15-4-8-22(24)29-20(15)12-17/h3-8,11-12,18,23H,2,9-10,13-14H2,1H3