9-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one

Systemtic Name: 9-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Openeye Name: 9-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one CAS Name: 9-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one IUPAC Name: 9-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Traditional Name: 4-phenyl-9-piperonyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Formula: C25H20NO5+ MolecularWeight: 414.43

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC3=C2OC(=O)C=C3C4=CC=CC=C4)OC[NH+]1CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1C2=C(C=CC3=C2OC(=O)C=C3C4=CC=CC=C4)OC[NH+]1CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C25H19NO5/c27-24-11-19(17-4-2-1-3-5-17)18-7-9-21-20(25(18)31-24)13-26(14-28-21)12-16-6-8-22-23(10-16)30-15-29-22/h1-11H,12-15H2/p+1