octan-1-amine; 1-(2-oxidanyl-5-oxidanylidene-2H-furan-3-yl)ethyl ethanoate

Systemtic Name: octan-1-amine; 1-(2-oxidanyl-5-oxidanylidene-2H-furan-3-yl)ethyl ethanoate Openeye Name: 1-(2-hydroxy-5-oxo-2H-furan-3-yl)ethyl acetate; octan-1-amine CAS Name: acetic acid 1-(2-hydroxy-5-oxo-2H-furan-3-yl)ethyl ester; 1-octanamine IUPAC Name: 1-(2-hydroxy-5-oxo-2H-furan-3-yl)ethyl acetate; octan-1-amine Traditional Name: acetic acid 1-(2-hydroxy-5-keto-2H-furan-3-yl)ethyl ester; octylamine Formula: C16H29NO5 MolecularWeight: 315.40516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN.CC(C1=CC(=O)OC1O)OC(=O)C

Isomeric SMILES

CCCCCCCCN.CC(C1=CC(=O)OC1O)OC(=O)C

InChI

InChI=1S/C8H19N.C8H10O5/c1-2-3-4-5-6-7-8-9;1-4(12-5(2)9)6-3-7(10)13-8(6)11/h2-9H2,1H3;3-4,8,11H,1-2H3