3-(3,4-dimethoxyphenyl)-9-propan-2-yl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-9-propan-2-yl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Openeye Name: 3-(3,4-dimethoxyphenyl)-9-isopropyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one CAS Name: 3-(3,4-dimethoxyphenyl)-9-propan-2-yl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one IUPAC Name: 3-(3,4-dimethoxyphenyl)-9-propan-2-yl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Traditional Name: 3-(3,4-dimethoxyphenyl)-9-isopropyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Formula: C22H24NO5+ MolecularWeight: 382.42966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC(=C(C=C4)OC)OC)OC1

Isomeric SMILES

CC(C)[NH+]1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC(=C(C=C4)OC)OC)OC1

InChI

InChI=1S/C22H23NO5/c1-13(2)23-10-16-18(28-12-23)8-6-15-21(24)17(11-27-22(15)16)14-5-7-19(25-3)20(9-14)26-4/h5-9,11,13H,10,12H2,1-4H3/p+1