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

Systemtic Name: 9-cyclopropyl-3-(2-methoxyphenoxy)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Openeye Name: 9-cyclopropyl-3-(2-methoxyphenoxy)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one CAS Name: 9-cyclopropyl-3-(2-methoxyphenoxy)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one IUPAC Name: 9-cyclopropyl-3-(2-methoxyphenoxy)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Traditional Name: 9-cyclopropyl-3-(2-methoxyphenoxy)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Formula: C21H20NO5+ MolecularWeight: 366.3872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC4=C3C[NH+](CO4)C5CC5

Isomeric SMILES

COC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC4=C3C[NH+](CO4)C5CC5

InChI

InChI=1S/C21H19NO5/c1-24-17-4-2-3-5-18(17)27-19-11-25-21-14(20(19)23)8-9-16-15(21)10-22(12-26-16)13-6-7-13/h2-5,8-9,11,13H,6-7,10,12H2,1H3/p+1