2-methyl-3-phenyl-9-propyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one

Systemtic Name: 2-methyl-3-phenyl-9-propyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Openeye Name: 2-methyl-3-phenyl-9-propyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one CAS Name: 2-methyl-3-phenyl-9-propyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one IUPAC Name: 2-methyl-3-phenyl-9-propyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Traditional Name: 2-methyl-3-phenyl-9-propyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Formula: C21H22NO3+ MolecularWeight: 336.40428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO3/c1-3-11-22-12-17-18(24-13-22)10-9-16-20(23)19(14(2)25-21(16)17)15-7-5-4-6-8-15/h4-10H,3,11-13H2,1-2H3/p+1