2-[2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylmethylamino)-2-oxidanylidene-ethyl]hexanoic acid

Systemtic Name: 2-[2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylmethylamino)-2-oxidanylidene-ethyl]hexanoic acid Openeye Name: 2-[2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylmethylamino)-2-oxo-ethyl]hexanoic acid CAS Name: 2-[2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylmethylamino)-2-oxoethyl]hexanoic acid IUPAC Name: 2-[2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylmethylamino)-2-oxoethyl]hexanoic acid Traditional Name: 2-[2-keto-2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylmethylamino)ethyl]hexanoic acid Formula: C15H23NO4 MolecularWeight: 281.34742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)NCC1CC2C=CC1O2)C(=O)O

Isomeric SMILES

CCCCC(CC(=O)NCC1CC2C=CC1O2)C(=O)O

InChI

InChI=1S/C15H23NO4/c1-2-3-4-10(15(18)19)8-14(17)16-9-11-7-12-5-6-13(11)20-12/h5-6,10-13H,2-4,7-9H2,1H3,(H,16,17)(H,18,19)