N-[(2S)-13-(3,4-dimethyl-5-pentyl-furan-2-yl)-1-oxidanyl-3-oxidanylidene-tridecan-2-yl]ethanamide

Systemtic Name: N-[(2S)-13-(3,4-dimethyl-5-pentyl-furan-2-yl)-1-oxidanyl-3-oxidanylidene-tridecan-2-yl]ethanamide Openeye Name: N-[(1S)-12-(3,4-dimethyl-5-pentyl-2-furyl)-1-(hydroxymethyl)-2-oxo-dodecyl]acetamide CAS Name: N-[(2S)-13-(3,4-dimethyl-5-pentyl-2-furanyl)-1-hydroxy-3-oxotridecan-2-yl]acetamide IUPAC Name: N-[(2S)-13-(3,4-dimethyl-5-pentylfuran-2-yl)-1-hydroxy-3-oxotridecan-2-yl]acetamide Traditional Name: N-[(1S)-12-(5-amyl-3,4-dimethyl-2-furyl)-2-keto-1-methylol-dodecyl]acetamide Formula: C26H45NO4 MolecularWeight: 435.6398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(O1)CCCCCCCCCCC(=O)C(CO)NC(=O)C)C)C

Isomeric SMILES

CCCCCC1=C(C(=C(O1)CCCCCCCCCCC(=O)[C@H](CO)NC(=O)C)C)C

InChI

InChI=1S/C26H45NO4/c1-5-6-13-17-25-20(2)21(3)26(31-25)18-15-12-10-8-7-9-11-14-16-24(30)23(19-28)27-22(4)29/h23,28H,5-19H2,1-4H3,(H,27,29)/t23-/m0/s1