3-(1,3-benzodioxol-5-ylmethyl)-10-methyl-6-propyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-10-methyl-6-propyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-10-methyl-6-propyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-10-methyl-6-propyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-10-methyl-6-propyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Traditional Name: 10-methyl-3-piperonyl-6-propyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Formula: C23H24NO5+ MolecularWeight: 394.44036

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C(C3=C(C[NH+](CO3)CC4=CC5=C(C=C4)OCO5)C=C12)C

Isomeric SMILES

CCCC1=CC(=O)OC2=C(C3=C(C[NH+](CO3)CC4=CC5=C(C=C4)OCO5)C=C12)C

InChI

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