methyl 2-(4-methyl-2-oxidanylidene-9-propyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-3-yl)ethanoate

Systemtic Name: methyl 2-(4-methyl-2-oxidanylidene-9-propyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-3-yl)ethanoate Openeye Name: methyl 2-(4-methyl-2-oxo-9-propyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-3-yl)acetate CAS Name: 2-(4-methyl-2-oxo-9-propyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-3-yl)acetic acid methyl ester IUPAC Name: methyl 2-(4-methyl-2-oxo-9-propyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-3-yl)acetate Traditional Name: 2-(2-keto-4-methyl-9-propyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-3-yl)acetic acid methyl ester Formula: C18H22NO5+ MolecularWeight: 332.37098

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CC2=C(C=CC3=C2OC(=O)C(=C3C)CC(=O)OC)OC1

Isomeric SMILES

CCC[NH+]1CC2=C(C=CC3=C2OC(=O)C(=C3C)CC(=O)OC)OC1

InChI

InChI=1S/C18H21NO5/c1-4-7-19-9-14-15(23-10-19)6-5-12-11(2)13(8-16(20)22-3)18(21)24-17(12)14/h5-6H,4,7-10H2,1-3H3/p+1