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

Systemtic Name: 4-ethyl-9-[(2S)-2-oxidanylpropyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Openeye Name: 4-ethyl-9-[(2S)-2-hydroxypropyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one CAS Name: 4-ethyl-9-[(2S)-2-hydroxypropyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one IUPAC Name: 4-ethyl-9-[(2S)-2-hydroxypropyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Traditional Name: 4-ethyl-9-[(2S)-2-hydroxypropyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Formula: C16H20NO4+ MolecularWeight: 290.3343

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC3=C2C[NH+](CO3)CC(C)O

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC3=C2C[NH+](CO3)C[C@H](C)O

InChI

InChI=1S/C16H19NO4/c1-3-11-6-15(19)21-16-12(11)4-5-14-13(16)8-17(9-20-14)7-10(2)18/h4-6,10,18H,3,7-9H2,1-2H3/p+1/t10-/m0/s1