N-[(1R,2S)-1,3-bis(oxidanyl)-1-(2-tridecylcyclopropen-1-yl)propan-2-yl]-2-oxidanylidene-2-phenyl-ethanamide

Systemtic Name: N-[(1R,2S)-1,3-bis(oxidanyl)-1-(2-tridecylcyclopropen-1-yl)propan-2-yl]-2-oxidanylidene-2-phenyl-ethanamide Openeye Name: N-[(1S,2R)-2-hydroxy-1-(hydroxymethyl)-2-(2-tridecylcyclopropen-1-yl)ethyl]-2-oxo-2-phenyl-acetamide CAS Name: N-[(1R,2S)-1,3-dihydroxy-1-(2-tridecyl-1-cyclopropenyl)propan-2-yl]-2-oxo-2-phenylacetamide IUPAC Name: N-[(1R,2S)-1,3-dihydroxy-1-(2-tridecylcyclopropen-1-yl)propan-2-yl]-2-oxo-2-phenylacetamide Traditional Name: N-[(1S,2R)-2-hydroxy-1-methylol-2-(2-tridecylcyclopropen-1-yl)ethyl]-2-keto-2-phenyl-acetamide Formula: C27H41NO4 MolecularWeight: 443.61874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=C(C1)C(C(CO)NC(=O)C(=O)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCCCCCCC1=C(C1)[C@H]([C@H](CO)NC(=O)C(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C27H41NO4/c1-2-3-4-5-6-7-8-9-10-11-13-18-22-19-23(22)26(31)24(20-29)28-27(32)25(30)21-16-14-12-15-17-21/h12,14-17,24,26,29,31H,2-11,13,18-20H2,1H3,(H,28,32)/t24-,26+/m0/s1