2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-nitro-chromen-4-one

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-nitro-chromen-4-one Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-nitro-chromen-4-one CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-nitro-1-benzopyran-4-one IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-nitrochromen-4-one Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-nitro-chromone Formula: C18H13NO6 MolecularWeight: 339.29892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C3=CC(=O)C4=C(O3)C=CC(=C4)[N+](=O)[O-])OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C3=CC(=O)C4=C(O3)C=CC(=C4)[N+](=O)[O-])OC1

InChI

InChI=1S/C18H13NO6/c20-14-10-17(25-15-5-3-12(19(21)22)9-13(14)15)11-2-4-16-18(8-11)24-7-1-6-23-16/h2-5,8-10H,1,6-7H2