hexyl-[1-[(3S,5R)-5-methyl-2,4-bis(oxidanylidene)oxolan-3-yl]ethylidene]azanium

Systemtic Name: hexyl-[1-[(3S,5R)-5-methyl-2,4-bis(oxidanylidene)oxolan-3-yl]ethylidene]azanium Openeye Name: hexyl-[1-[(3S,5R)-5-methyl-2,4-dioxo-tetrahydrofuran-3-yl]ethylidene]ammonium CAS Name: hexyl-[1-[(3S,5R)-5-methyl-2,4-dioxo-3-oxolanyl]ethylidene]ammonium IUPAC Name: hexyl-[1-[(3S,5R)-5-methyl-2,4-dioxooxolan-3-yl]ethylidene]azanium Traditional Name: 1-[(3S,5R)-2,4-diketo-5-methyl-tetrahydrofuran-3-yl]ethylidene-hexyl-ammonium Formula: C13H22NO3+ MolecularWeight: 240.31868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH+]=C(C)C1C(=O)C(OC1=O)C

Isomeric SMILES

CCCCCC[NH+]=C(C)[C@H]1C(=O)[C@H](OC1=O)C

InChI

InChI=1S/C13H21NO3/c1-4-5-6-7-8-14-9(2)11-12(15)10(3)17-13(11)16/h10-11H,4-8H2,1-3H3/p+1/t10-,11+/m1/s1