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

Systemtic Name: 9-(1,3-benzodioxol-5-ylmethyl)-4-butyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Openeye Name: 9-(1,3-benzodioxol-5-ylmethyl)-4-butyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one CAS Name: 9-(1,3-benzodioxol-5-ylmethyl)-4-butyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one IUPAC Name: 9-(1,3-benzodioxol-5-ylmethyl)-4-butyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Traditional Name: 4-butyl-9-piperonyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Formula: C23H24NO5+ MolecularWeight: 394.44036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC3=C2C[NH+](CO3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC3=C2C[NH+](CO3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H23NO5/c1-2-3-4-16-10-22(25)29-23-17(16)6-8-19-18(23)12-24(13-26-19)11-15-5-7-20-21(9-15)28-14-27-20/h5-10H,2-4,11-14H2,1H3/p+1